methyl 4-[[4-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-(3-oxo-3-pyrrolidin-1-yl-propyl)-1-piperidyl]methyl]benzoate CAS Name: 4-[[4-[3-oxo-3-(1-pyrrolidinyl)propyl]-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(3-oxo-3-pyrrolidin-1-ylpropyl)piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[4-(3-keto-3-pyrrolidino-propyl)piperidino]methyl]benzoic acid methyl ester Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCC(CC2)CCC(=O)N3CCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCC(CC2)CCC(=O)N3CCCC3

InChI

InChI=1S/C21H30N2O3/c1-26-21(25)19-7-4-18(5-8-19)16-22-14-10-17(11-15-22)6-9-20(24)23-12-2-3-13-23/h4-5,7-8,17H,2-3,6,9-16H2,1H3