2-[[4-[2-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-3-nitro-phenyl]sulfonylamino]benzoate

Systemtic Name: 2-[[4-[2-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-3-nitro-phenyl]sulfonylamino]benzoate Openeye Name: 2-[[4-[2-[(5-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazino]-3-nitro-phenyl]sulfonylamino]benzoate CAS Name: 2-[[4-[(5-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylhydrazo]-3-nitrophenyl]sulfonylamino]benzoate IUPAC Name: 2-[[4-[2-[(5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-3-nitrophenyl]sulfonylamino]benzoate Traditional Name: 2-[[4-[N'-[(6-keto-5-methoxy-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazino]-3-nitro-phenyl]sulfonylamino]benzoate Formula: C21H17N4O8S- MolecularWeight: 485.44668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=CNNC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3C(=O)[O-])[N+](=O)[O-])C1=O

Isomeric SMILES

COC1=CC=CC(=CNNC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3C(=O)[O-])[N+](=O)[O-])C1=O

InChI

InChI=1S/C21H18N4O8S/c1-33-19-8-4-5-13(20(19)26)12-22-23-17-10-9-14(11-18(17)25(29)30)34(31,32)24-16-7-3-2-6-15(16)21(27)28/h2-12,22-24H,1H3,(H,27,28)/p-1