2-[2,3-bis(chloranyl)-4-(1-methylindol-5-yl)sulfanyl-phenyl]prop-2-enoic acid

Systemtic Name: 2-[2,3-bis(chloranyl)-4-(1-methylindol-5-yl)sulfanyl-phenyl]prop-2-enoic acid Openeye Name: 2-[2,3-dichloro-4-(1-methylindol-5-yl)sulfanyl-phenyl]prop-2-enoic acid CAS Name: 2-[2,3-dichloro-4-[(1-methyl-5-indolyl)thio]phenyl]-2-propenoic acid IUPAC Name: 2-[2,3-dichloro-4-(1-methylindol-5-yl)sulfanylphenyl]prop-2-enoic acid Traditional Name: 2-[2,3-dichloro-4-[(1-methylindol-5-yl)thio]phenyl]acrylic acid Formula: C18H13Cl2NO2S MolecularWeight: 378.27232

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)SC3=C(C(=C(C=C3)C(=C)C(=O)O)Cl)Cl

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)SC3=C(C(=C(C=C3)C(=C)C(=O)O)Cl)Cl

InChI

InChI=1S/C18H13Cl2NO2S/c1-10(18(22)23)13-4-6-15(17(20)16(13)19)24-12-3-5-14-11(9-12)7-8-21(14)2/h3-9H,1H2,2H3,(H,22,23)