2-[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: 2-[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: 2-[2-(3-chloro-4-cyano-anilino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(3-chloro-4-cyanoanilino)-2-oxoethyl]thio]benzoate IUPAC Name: 2-[2-(3-chloro-4-cyanoanilino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(3-chloro-4-cyano-anilino)-2-keto-ethyl]thio]benzoate Formula: C16H10ClN2O3S- MolecularWeight: 345.7802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])SCC(=O)NC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])SCC(=O)NC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C16H11ClN2O3S/c17-13-7-11(6-5-10(13)8-18)19-15(20)9-23-14-4-2-1-3-12(14)16(21)22/h1-7H,9H2,(H,19,20)(H,21,22)/p-1