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

Systemtic Name: ethyl 4-[cyclohexyl-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[cyclohexyl-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]amino]-4-oxo-butanoate CAS Name: 4-[cyclohexyl-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[cyclohexyl-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]amino]-4-oxobutanoate Traditional Name: 4-[cyclohexyl-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]amino]-4-keto-butyric acid ethyl ester Formula: C25H34N2O3 MolecularWeight: 410.54906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N(CC1=CC=CN1CC2=CC=CC=C2C)C3CCCCC3

Isomeric SMILES

CCOC(=O)CCC(=O)N(CC1=CC=CN1CC2=CC=CC=C2C)C3CCCCC3

InChI

InChI=1S/C25H34N2O3/c1-3-30-25(29)16-15-24(28)27(22-12-5-4-6-13-22)19-23-14-9-17-26(23)18-21-11-8-7-10-20(21)2/h7-11,14,17,22H,3-6,12-13,15-16,18-19H2,1-2H3