4-[(E)-(4-phenoxycarbonylphenyl)methylideneamino]sulfonylbenzoic acid

Systemtic Name: 4-[(E)-(4-phenoxycarbonylphenyl)methylideneamino]sulfonylbenzoic acid Openeye Name: 4-[(E)-(4-phenoxycarbonylphenyl)methyleneamino]sulfonylbenzoic acid CAS Name: 4-[(E)-[4-[oxo(phenoxy)methyl]phenyl]methylideneamino]sulfonylbenzoic acid IUPAC Name: 4-[(E)-(4-phenoxycarbonylphenyl)methylideneamino]sulfonylbenzoic acid Traditional Name: 4-[(E)-(4-carbophenoxybenzylidene)amino]sulfonylbenzoic acid Formula: C21H15NO6S MolecularWeight: 409.4119

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C=NS(=O)(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)/C=N/S(=O)(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H15NO6S/c23-20(24)16-10-12-19(13-11-16)29(26,27)22-14-15-6-8-17(9-7-15)21(25)28-18-4-2-1-3-5-18/h1-14H,(H,23,24)/b22-14+