methyl 1-[2-[(2-chloranyl-5-methylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-[(2-chloranyl-5-methylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-(2-chloro-5-methylsulfonyl-anilino)-2-oxo-ethyl]indole-3-carboxylate CAS Name: 1-[2-(2-chloro-5-methylsulfonylanilino)-2-oxoethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(2-chloro-5-methylsulfonylanilino)-2-oxoethyl]indole-3-carboxylate Traditional Name: 1-[2-(2-chloro-5-mesyl-anilino)-2-keto-ethyl]indole-3-carboxylic acid methyl ester Formula: C19H17ClN2O5S MolecularWeight: 420.86668

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)Cl

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C19H17ClN2O5S/c1-27-19(24)14-10-22(17-6-4-3-5-13(14)17)11-18(23)21-16-9-12(28(2,25)26)7-8-15(16)20/h3-10H,11H2,1-2H3,(H,21,23)