3-[[4-[[4-[(4,8-disulfonaphthalen-2-yl)diazenyl]-3-(2-oxidanylethanoylamino)phenyl]carbamoylamino]-2-(2-oxidanylethanoylamino)phenyl]diazenyl]naphthalene-1,5-disulfonic acid

Systemtic Name: 3-[[4-[[4-[(4,8-disulfonaphthalen-2-yl)diazenyl]-3-(2-oxidanylethanoylamino)phenyl]carbamoylamino]-2-(2-oxidanylethanoylamino)phenyl]diazenyl]naphthalene-1,5-disulfonic acid Openeye Name: 3-[4-[[4-[(4,8-disulfo-2-naphthyl)azo]-3-[(2-hydroxyacetyl)amino]phenyl]carbamoylamino]-2-[(2-hydroxyacetyl)amino]phenyl]azonaphthalene-1,5-disulfonic acid CAS Name: 3-[4-[[[4-[(4,8-disulfo-2-naphthalenyl)azo]-3-[(2-hydroxy-1-oxoethyl)amino]anilino]-oxomethyl]amino]-2-[(2-hydroxy-1-oxoethyl)amino]phenyl]azonaphthalene-1,5-disulfonic acid IUPAC Name: 3-[[4-[[4-[(4,8-disulfonaphthalen-2-yl)diazenyl]-3-[(2-hydroxyacetyl)amino]phenyl]carbamoylamino]-2-[(2-hydroxyacetyl)amino]phenyl]diazenyl]naphthalene-1,5-disulfonic acid Traditional Name: 3-[4-[[4-[(4,8-disulfo-2-naphthyl)azo]-3-(glycoloylamino)phenyl]carbamoylamino]-2-(glycoloylamino)phenyl]azonaphthalene-1,5-disulfonic acid Formula: C37H30N8O17S4 MolecularWeight: 986.9375

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C(C=C2C(=C1)S(=O)(=O)O)N=NC3=C(C=C(C=C3)NC(=O)NC4=CC(=C(C=C4)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)O)S(=O)(=O)O)NC(=O)CO)NC(=O)CO)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=C(C=C2C(=C1)S(=O)(=O)O)N=NC3=C(C=C(C=C3)NC(=O)NC4=CC(=C(C=C4)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)O)S(=O)(=O)O)NC(=O)CO)NC(=O)CO)S(=O)(=O)O

InChI

InChI=1S/C37H30N8O17S4/c46-17-35(48)40-29-13-19(7-9-27(29)44-42-21-11-25-23(33(15-21)65(57,58)59)3-1-5-31(25)63(51,52)53)38-37(50)39-20-8-10-28(30(14-20)41-36(49)18-47)45-43-22-12-26-24(34(16-22)66(60,61)62)4-2-6-32(26)64(54,55)56/h1-16,46-47H,17-18H2,(H,40,48)(H,41,49)(H2,38,39,50)(H,51,52,53)(H,54,55,56)(H,57,58,59)(H,60,61,62)