1-[(2Z)-2-(7-azanyl-1-oxidanylidene-3-sulfo-naphthalen-2-ylidene)hydrazinyl]-4-methoxy-5-phenyldiazenyl-naphthalene-2,6-dicarboxylic acid

Systemtic Name: 1-[(2Z)-2-(7-azanyl-1-oxidanylidene-3-sulfo-naphthalen-2-ylidene)hydrazinyl]-4-methoxy-5-phenyldiazenyl-naphthalene-2,6-dicarboxylic acid Openeye Name: 1-[(2Z)-2-(7-amino-1-oxo-3-sulfo-2-naphthylidene)hydrazino]-4-methoxy-5-phenylazo-naphthalene-2,6-dicarboxylic acid CAS Name: 1-[(2Z)-2-(7-amino-1-oxo-3-sulfo-2-naphthalenylidene)hydrazinyl]-4-methoxy-5-phenyldiazenylnaphthalene-2,6-dicarboxylic acid IUPAC Name: 1-[(2Z)-2-(7-amino-1-oxo-3-sulfonaphthalen-2-ylidene)hydrazinyl]-4-methoxy-5-phenyldiazenylnaphthalene-2,6-dicarboxylic acid Traditional Name: 1-[(N'Z)-N'-(7-amino-1-keto-3-sulfo-2-naphthylidene)hydrazino]-4-methoxy-5-phenylazo-naphthalene-2,6-dicarboxylic acid Formula: C29H21N5O9S MolecularWeight: 615.57014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C(=C1)C(=O)O)NN=C3C(=CC4=C(C3=O)C=C(C=C4)N)S(=O)(=O)O)C=CC(=C2N=NC5=CC=CC=C5)C(=O)O

Isomeric SMILES

COC1=C2C(=C(C(=C1)C(=O)O)N/N=C/3\C(=CC4=C(C3=O)C=C(C=C4)N)S(=O)(=O)O)C=CC(=C2N=NC5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C29H21N5O9S/c1-43-21-13-20(29(38)39)24(17-9-10-18(28(36)37)25(23(17)21)33-31-16-5-3-2-4-6-16)32-34-26-22(44(40,41)42)11-14-7-8-15(30)12-19(14)27(26)35/h2-13,32H,30H2,1H3,(H,36,37)(H,38,39)(H,40,41,42)/b33-31?,34-26+