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3-[2-[1-oxidanylidene-6-[[5-oxidanylidene-6-(phenylhydrazinylidene)-7-sulfonato-naphthalen-2-yl]carbamoylamino]-3-sulfonato-naphthalen-2-ylidene]hydrazinyl]benzoate

3-[2-[1-oxidanylidene-6-[[5-oxidanylidene-6-(phenylhydrazinylidene)-7-sulfonato-naphthalen-2-yl]carbamoylamino]-3-sulfonato-naphthalen-2-ylidene]hydrazinyl]benzoate

Systemtic Name:3-[2-[1-oxidanylidene-6-[[5-oxidanylidene-6-(phenylhydrazinylidene)-7-sulfonato-naphthalen-2-yl]carbamoylamino]-3-sulfonato-naphthalen-2-ylidene]hydrazinyl]benzoate
Openeye Name:3-[2-[1-oxo-6-[[5-oxo-6-(phenylhydrazono)-7-sulfonato-2-naphthyl]carbamoylamino]-3-sulfonato-2-naphthylidene]hydrazino]benzoate
CAS Name:3-[2-[1-oxo-6-[[oxo-[[5-oxo-6-(phenylhydrazinylidene)-7-sulfonato-2-naphthalenyl]amino]methyl]amino]-3-sulfonato-2-naphthalenylidene]hydrazinyl]benzoate
IUPAC Name:3-[2-[1-oxo-6-[[5-oxo-6-(phenylhydrazinylidene)-7-sulfonatonaphthalen-2-yl]carbamoylamino]-3-sulfonatonaphthalen-2-ylidene]hydrazinyl]benzoate
Traditional Name:3-[N'-[1-keto-6-[[5-keto-6-(phenylhydrazono)-7-sulfonato-2-naphthyl]carbamoylamino]-3-sulfonato-2-naphthylidene]hydrazino]benzoate
Formula: C34H21N6O11S2-3
MolecularWeight: 753.69414
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NN=C2C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)C(=NNC6=CC=CC(=C6)C(=O)[O-])C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-]


Isomeric SMILES

C1=CC=C(C=C1)NN=C2C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)C(=NNC6=CC=CC(=C6)C(=O)[O-])C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-]


InChI

InChI=1S/C34H24N6O11S2/c41-31-25-11-9-22(14-19(25)16-27(52(46,47)48)29(31)39-37-21-6-2-1-3-7-21)35-34(45)36-23-10-12-26-20(15-23)17-28(53(49,50)51)30(32(26)42)40-38-24-8-4-5-18(13-24)33(43)44/h1-17,37-38H,(H,43,44)(H2,35,36,45)(H,46,47,48)(H,49,50,51)/p-3


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