methyl 4-[3-[[(3,5-dimethoxyphenyl)carbonylamino]methyl]piperidin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[3-[[(3,5-dimethoxyphenyl)carbonylamino]methyl]piperidin-1-yl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[3-[[(3,5-dimethoxybenzoyl)amino]methyl]-1-piperidyl]-4-oxo-butanoate CAS Name: 4-[3-[[[(3,5-dimethoxyphenyl)-oxomethyl]amino]methyl]-1-piperidinyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[3-[[(3,5-dimethoxybenzoyl)amino]methyl]piperidin-1-yl]-4-oxobutanoate Traditional Name: 4-[3-[[(3,5-dimethoxybenzoyl)amino]methyl]piperidino]-4-keto-butyric acid methyl ester Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NCC2CCCN(C2)C(=O)CCC(=O)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NCC2CCCN(C2)C(=O)CCC(=O)OC)OC

InChI

InChI=1S/C20H28N2O6/c1-26-16-9-15(10-17(11-16)27-2)20(25)21-12-14-5-4-8-22(13-14)18(23)6-7-19(24)28-3/h9-11,14H,4-8,12-13H2,1-3H3,(H,21,25)