methyl 1-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)-2-(2-methylpropyl)indole-6-carboxylate

Systemtic Name: methyl 1-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)-2-(2-methylpropyl)indole-6-carboxylate Openeye Name: methyl 1-[(2-chlorophenyl)methyl]-2-isobutyl-3-(2-methylpropanoyl)indole-6-carboxylate CAS Name: 1-[(2-chlorophenyl)methyl]-3-(2-methyl-1-oxopropyl)-2-(2-methylpropyl)-6-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)-2-(2-methylpropyl)indole-6-carboxylate Traditional Name: 1-(2-chlorobenzyl)-2-isobutyl-3-isobutyryl-indole-6-carboxylic acid methyl ester Formula: C25H28ClNO3 MolecularWeight: 425.94772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C2=C(N1CC3=CC=CC=C3Cl)C=C(C=C2)C(=O)OC)C(=O)C(C)C

Isomeric SMILES

CC(C)CC1=C(C2=C(N1CC3=CC=CC=C3Cl)C=C(C=C2)C(=O)OC)C(=O)C(C)C

InChI

InChI=1S/C25H28ClNO3/c1-15(2)12-22-23(24(28)16(3)4)19-11-10-17(25(29)30-5)13-21(19)27(22)14-18-8-6-7-9-20(18)26/h6-11,13,15-16H,12,14H2,1-5H3