4-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]benzenesulfonate

Systemtic Name: 4-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]benzenesulfonate Openeye Name: 4-[(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]benzenesulfonate CAS Name: 4-[(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]benzenesulfonate IUPAC Name: 4-[(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]benzenesulfonate Traditional Name: 4-[(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]besylate Formula: C14H12NO5S- MolecularWeight: 306.31378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNC2=CC=C(C=C2)S(=O)(=O)[O-])C=CC1=O

Isomeric SMILES

COC1=CC(=CNC2=CC=C(C=C2)S(=O)(=O)[O-])C=CC1=O

InChI

InChI=1S/C14H13NO5S/c1-20-14-8-10(2-7-13(14)16)9-15-11-3-5-12(6-4-11)21(17,18)19/h2-9,15H,1H3,(H,17,18,19)/p-1