ethyl 4-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl-(phenylmethyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl-(phenylmethyl)amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[benzyl-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]amino]-4-oxo-butanoate CAS Name: 4-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl-(phenylmethyl)amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[benzyl-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]amino]-4-oxobutanoate Traditional Name: 4-[benzyl-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]amino]-4-keto-butyric acid ethyl ester Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2CC3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)CCC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2CC3=CC=CC=C3C

InChI

InChI=1S/C26H30N2O3/c1-3-31-26(30)16-15-25(29)28(18-22-11-5-4-6-12-22)20-24-14-9-17-27(24)19-23-13-8-7-10-21(23)2/h4-14,17H,3,15-16,18-20H2,1-2H3