2-[2-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]ethoxycarbonyl]benzenesulfonate

Systemtic Name: 2-[2-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]ethoxycarbonyl]benzenesulfonate Openeye Name: 2-[2-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethoxycarbonyl]benzenesulfonate CAS Name: 2-[oxo-[2-[[(E)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]ethoxy]methyl]benzenesulfonate IUPAC Name: 2-[2-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethoxycarbonyl]benzenesulfonate Traditional Name: 2-[2-[[(E)-(6-ketocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethoxycarbonyl]besylate Formula: C16H14NO6S- MolecularWeight: 348.35046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCCNC=C2C=CC=CC2=O)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCCN/C=C/2\C=CC=CC2=O)S(=O)(=O)[O-]

InChI

InChI=1S/C16H15NO6S/c18-14-7-3-1-5-12(14)11-17-9-10-23-16(19)13-6-2-4-8-15(13)24(20,21)22/h1-8,11,17H,9-10H2,(H,20,21,22)/p-1/b12-11+