1,2-bis(2-methylphenyl)guanidine; 7-[(2Z)-2-[3-[(6,8-disulfonaphthalen-2-yl)diazenyl]-4-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]hydrazinyl]naphthalene-1,3-disulfonic acid

Systemtic Name: 1,2-bis(2-methylphenyl)guanidine; 7-[(2Z)-2-[3-[(6,8-disulfonaphthalen-2-yl)diazenyl]-4-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]hydrazinyl]naphthalene-1,3-disulfonic acid Openeye Name: 1,2-bis(o-tolyl)guanidine; 7-[(2Z)-2-[3-[(6,8-disulfo-2-naphthyl)azo]-4-hydroxy-6-oxo-cyclohexa-2,4-dien-1-ylidene]hydrazino]naphthalene-1,3-disulfonic acid CAS Name: 1,2-bis(2-methylphenyl)guanidine; 7-[(2Z)-2-[3-[(6,8-disulfo-2-naphthalenyl)azo]-4-hydroxy-6-oxo-1-cyclohexa-2,4-dienylidene]hydrazinyl]naphthalene-1,3-disulfonic acid IUPAC Name: 1,2-bis(2-methylphenyl)guanidine; 7-[(2Z)-2-[3-[(6,8-disulfonaphthalen-2-yl)diazenyl]-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinyl]naphthalene-1,3-disulfonic acid Traditional Name: 1,2-bis(o-tolyl)guanidine; 7-[(N'Z)-N'-[3-[(6,8-disulfo-2-naphthyl)azo]-4-hydroxy-6-keto-cyclohexa-2,4-dien-1-ylidene]hydrazino]naphthalene-1,3-disulfonic acid Formula: C86H86N16O14S4 MolecularWeight: 1695.96184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)S(=O)(=O)O)NN=C3C=C(C(=CC3=O)O)N=NC4=CC5=C(C=C(C=C5C=C4)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)S(=O)(=O)O)N/N=C\3/C=C(C(=CC3=O)O)N=NC4=CC5=C(C=C(C=C5C=C4)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C26H18N4O14S4.4C15H17N3/c31-23-12-24(32)22(30-28-16-4-2-14-6-18(46(36,37)38)10-26(20(14)8-16)48(42,43)44)11-21(23)29-27-15-3-1-13-5-17(45(33,34)35)9-25(19(13)7-15)47(39,40)41;4*1-11-7-3-5-9-13(11)17-15(16)18-14-10-6-4-8-12(14)2/h1-12,27,32H,(H,33,34,35)(H,36,37,38)(H,39,40,41)(H,42,43,44);4*3-10H,1-2H3,(H3,16,17,18)/b29-21-,30-28?;;;;