ethyl 4-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl-(2-methylpropyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl-(2-methylpropyl)amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl-isobutyl-amino]-4-oxo-butanoate CAS Name: 4-[[1-[(3-chlorophenyl)methyl]-2-pyrrolyl]methyl-(2-methylpropyl)amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl-(2-methylpropyl)amino]-4-oxobutanoate Traditional Name: 4-[[1-(3-chlorobenzyl)pyrrol-2-yl]methyl-isobutyl-amino]-4-keto-butyric acid ethyl ester Formula: C22H29ClN2O3 MolecularWeight: 404.93026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N(CC1=CC=CN1CC2=CC(=CC=C2)Cl)CC(C)C

Isomeric SMILES

CCOC(=O)CCC(=O)N(CC1=CC=CN1CC2=CC(=CC=C2)Cl)CC(C)C

InChI

InChI=1S/C22H29ClN2O3/c1-4-28-22(27)11-10-21(26)25(14-17(2)3)16-20-9-6-12-24(20)15-18-7-5-8-19(23)13-18/h5-9,12-13,17H,4,10-11,14-16H2,1-3H3