7-[[2-(aminocarbonylamino)-4-azanyl-phenyl]diazenyl]-3-methyl-naphthalene-1,6-disulfonic acid

Systemtic Name: 7-[[2-(aminocarbonylamino)-4-azanyl-phenyl]diazenyl]-3-methyl-naphthalene-1,6-disulfonic acid Openeye Name: 7-(4-amino-2-ureido-phenyl)azo-3-methyl-naphthalene-1,6-disulfonic acid CAS Name: 7-[4-amino-2-(carbamoylamino)phenyl]azo-3-methylnaphthalene-1,6-disulfonic acid IUPAC Name: 7-[[4-amino-2-(carbamoylamino)phenyl]diazenyl]-3-methylnaphthalene-1,6-disulfonic acid Traditional Name: 7-(4-amino-2-ureido-phenyl)azo-3-methyl-naphthalene-1,6-disulfonic acid Formula: C18H17N5O7S2 MolecularWeight: 479.48688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=CC2=C1)S(=O)(=O)O)N=NC3=C(C=C(C=C3)N)NC(=O)N)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C2C=C(C(=CC2=C1)S(=O)(=O)O)N=NC3=C(C=C(C=C3)N)NC(=O)N)S(=O)(=O)O

InChI

InChI=1S/C18H17N5O7S2/c1-9-4-10-6-17(32(28,29)30)15(8-12(10)16(5-9)31(25,26)27)23-22-13-3-2-11(19)7-14(13)21-18(20)24/h2-8H,19H2,1H3,(H3,20,21,24)(H,25,26,27)(H,28,29,30)