6-[(2-sulfanylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: 6-[(2-sulfanylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: 6-[(2-sulfanylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: 6-[(2-mercaptoanilino)-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: 6-[(2-sulfanylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: 6-[(2-mercaptophenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C14H14NO3S- MolecularWeight: 276.33086

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NC2=CC=CC=C2S)C(=O)[O-]

Isomeric SMILES

C1C=CCC(C1C(=O)NC2=CC=CC=C2S)C(=O)[O-]

InChI

InChI=1S/C14H15NO3S/c16-13(15-11-7-3-4-8-12(11)19)9-5-1-2-6-10(9)14(17)18/h1-4,7-10,19H,5-6H2,(H,15,16)(H,17,18)/p-1