methyl 4-[[2-(5-oxidanylidene-1-phenethyl-pyrrolidin-2-yl)ethylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(5-oxidanylidene-1-phenethyl-pyrrolidin-2-yl)ethylamino]methyl]benzoate Openeye Name: methyl 4-[[2-(5-oxo-1-phenethyl-pyrrolidin-2-yl)ethylamino]methyl]benzoate CAS Name: 4-[[2-(5-oxo-1-phenethyl-2-pyrrolidinyl)ethylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(5-oxo-1-phenethylpyrrolidin-2-yl)ethylamino]methyl]benzoate Traditional Name: 4-[[2-(5-keto-1-phenethyl-pyrrolidin-2-yl)ethylamino]methyl]benzoic acid methyl ester Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNCCC2CCC(=O)N2CCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNCCC2CCC(=O)N2CCC3=CC=CC=C3

InChI

InChI=1S/C23H28N2O3/c1-28-23(27)20-9-7-19(8-10-20)17-24-15-13-21-11-12-22(26)25(21)16-14-18-5-3-2-4-6-18/h2-10,21,24H,11-17H2,1H3