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

Systemtic Name: methyl 1-[(2-chlorophenyl)methyl]-3-ethanoyl-2-propyl-indole-6-carboxylate Openeye Name: methyl 3-acetyl-1-[(2-chlorophenyl)methyl]-2-propyl-indole-6-carboxylate CAS Name: 3-acetyl-1-[(2-chlorophenyl)methyl]-2-propyl-6-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-acetyl-1-[(2-chlorophenyl)methyl]-2-propylindole-6-carboxylate Traditional Name: 3-acetyl-1-(2-chlorobenzyl)-2-propyl-indole-6-carboxylic acid methyl ester Formula: C22H22ClNO3 MolecularWeight: 383.86798

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C22H22ClNO3/c1-4-7-19-21(14(2)25)17-11-10-15(22(26)27-3)12-20(17)24(19)13-16-8-5-6-9-18(16)23/h5-6,8-12H,4,7,13H2,1-3H3