methyl 1-[(2-chlorophenyl)methyl]-3-(phenylcarbonyl)-2-propyl-indole-6-carboxylate

Systemtic Name: methyl 1-[(2-chlorophenyl)methyl]-3-(phenylcarbonyl)-2-propyl-indole-6-carboxylate Openeye Name: methyl 3-benzoyl-1-[(2-chlorophenyl)methyl]-2-propyl-indole-6-carboxylate CAS Name: 3-benzoyl-1-[(2-chlorophenyl)methyl]-2-propyl-6-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-benzoyl-1-[(2-chlorophenyl)methyl]-2-propylindole-6-carboxylate Traditional Name: 3-benzoyl-1-(2-chlorobenzyl)-2-propyl-indole-6-carboxylic acid methyl ester Formula: C27H24ClNO3 MolecularWeight: 445.93736

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1CC3=CC=CC=C3Cl)C=C(C=C2)C(=O)OC)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCCC1=C(C2=C(N1CC3=CC=CC=C3Cl)C=C(C=C2)C(=O)OC)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H24ClNO3/c1-3-9-23-25(26(30)18-10-5-4-6-11-18)21-15-14-19(27(31)32-2)16-24(21)29(23)17-20-12-7-8-13-22(20)28/h4-8,10-16H,3,9,17H2,1-2H3