methyl 4-[2-[[1-(2-phenylethanoyl)piperidin-3-yl]carbonylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[[1-(2-phenylethanoyl)piperidin-3-yl]carbonylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[[1-(2-phenylacetyl)piperidine-3-carbonyl]amino]ethyl]benzoate CAS Name: 4-[2-[[oxo-[1-(1-oxo-2-phenylethyl)-3-piperidinyl]methyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[1-(2-phenylacetyl)piperidine-3-carbonyl]amino]ethyl]benzoate Traditional Name: 4-[2-[[1-(2-phenylacetyl)nipecotoyl]amino]ethyl]benzoic acid methyl ester Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCNC(=O)C2CCCN(C2)C(=O)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCNC(=O)C2CCCN(C2)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C24H28N2O4/c1-30-24(29)20-11-9-18(10-12-20)13-14-25-23(28)21-8-5-15-26(17-21)22(27)16-19-6-3-2-4-7-19/h2-4,6-7,9-12,21H,5,8,13-17H2,1H3,(H,25,28)