methyl 5-chloranyl-3-(4-propan-2-ylphenyl)sulfonyl-1H-indole-2-carboxylate

Systemtic Name: methyl 5-chloranyl-3-(4-propan-2-ylphenyl)sulfonyl-1H-indole-2-carboxylate Openeye Name: methyl 5-chloro-3-(4-isopropylphenyl)sulfonyl-1H-indole-2-carboxylate CAS Name: 5-chloro-3-(4-propan-2-ylphenyl)sulfonyl-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-chloro-3-(4-propan-2-ylphenyl)sulfonyl-1H-indole-2-carboxylate Traditional Name: 5-chloro-3-p-cumenylsulfonyl-1H-indole-2-carboxylic acid methyl ester Formula: C19H18ClNO4S MolecularWeight: 391.86852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C19H18ClNO4S/c1-11(2)12-4-7-14(8-5-12)26(23,24)18-15-10-13(20)6-9-16(15)21-17(18)19(22)25-3/h4-11,21H,1-3H3