2-[2-[2,3-bis(chloranyl)-4-sulfanyl-phenyl]prop-2-enoyl-phenyl-amino]ethanoic acid

Systemtic Name: 2-[2-[2,3-bis(chloranyl)-4-sulfanyl-phenyl]prop-2-enoyl-phenyl-amino]ethanoic acid Openeye Name: 2-[N-[2-(2,3-dichloro-4-sulfanyl-phenyl)prop-2-enoyl]anilino]acetic acid CAS Name: 2-(N-[2-(2,3-dichloro-4-mercaptophenyl)-1-oxoprop-2-enyl]anilino)acetic acid IUPAC Name: 2-[N-[2-(2,3-dichloro-4-sulfanylphenyl)prop-2-enoyl]anilino]acetic acid Traditional Name: 2-(N-[2-(2,3-dichloro-4-mercapto-phenyl)acryloyl]anilino)acetic acid Formula: C17H13Cl2NO3S MolecularWeight: 382.26102

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=C(C(=C(C=C1)S)Cl)Cl)C(=O)N(CC(=O)O)C2=CC=CC=C2

Isomeric SMILES

C=C(C1=C(C(=C(C=C1)S)Cl)Cl)C(=O)N(CC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C17H13Cl2NO3S/c1-10(12-7-8-13(24)16(19)15(12)18)17(23)20(9-14(21)22)11-5-3-2-4-6-11/h2-8,24H,1,9H2,(H,21,22)