(phenylmethyl) 1-(2-chlorophenyl)carbonyl-3-(2-methylpropanoyl)-2-propyl-indole-6-carboxylate

Systemtic Name: (phenylmethyl) 1-(2-chlorophenyl)carbonyl-3-(2-methylpropanoyl)-2-propyl-indole-6-carboxylate Openeye Name: benzyl 1-(2-chlorobenzoyl)-3-(2-methylpropanoyl)-2-propyl-indole-6-carboxylate CAS Name: 1-[(2-chlorophenyl)-oxomethyl]-3-(2-methyl-1-oxopropyl)-2-propyl-6-indolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-(2-chlorobenzoyl)-3-(2-methylpropanoyl)-2-propylindole-6-carboxylate Traditional Name: 1-(2-chlorobenzoyl)-3-isobutyryl-2-propyl-indole-6-carboxylic acid benzyl ester Formula: C30H28ClNO4 MolecularWeight: 502.00062

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1C(=O)C3=CC=CC=C3Cl)C=C(C=C2)C(=O)OCC4=CC=CC=C4)C(=O)C(C)C

Isomeric SMILES

CCCC1=C(C2=C(N1C(=O)C3=CC=CC=C3Cl)C=C(C=C2)C(=O)OCC4=CC=CC=C4)C(=O)C(C)C

InChI

InChI=1S/C30H28ClNO4/c1-4-10-25-27(28(33)19(2)3)23-16-15-21(30(35)36-18-20-11-6-5-7-12-20)17-26(23)32(25)29(34)22-13-8-9-14-24(22)31/h5-9,11-17,19H,4,10,18H2,1-3H3