methyl 2-[4-[(1-phenylpiperidin-2-yl)carbonylamino]cyclohexyl]oxyethanoate hydrochloride

Systemtic Name: methyl 2-[4-[(1-phenylpiperidin-2-yl)carbonylamino]cyclohexyl]oxyethanoate hydrochloride Openeye Name: methyl 2-[4-[(1-phenylpiperidine-2-carbonyl)amino]cyclohexoxy]acetate hydrochloride CAS Name: 2-[4-[[oxo-(1-phenyl-2-piperidinyl)methyl]amino]cyclohexyl]oxyacetic acid methyl ester hydrochloride IUPAC Name: methyl 2-[4-[(1-phenylpiperidine-2-carbonyl)amino]cyclohexyl]oxyacetate hydrochloride Traditional Name: 2-[4-[(1-phenylpipecoloyl)amino]cyclohexoxy]acetic acid methyl ester hydrochloride Formula: C21H31ClN2O4 MolecularWeight: 410.93484

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1CCC(CC1)NC(=O)C2CCCCN2C3=CC=CC=C3.Cl

Isomeric SMILES

COC(=O)COC1CCC(CC1)NC(=O)C2CCCCN2C3=CC=CC=C3.Cl

InChI

InChI=1S/C21H30N2O4.ClH/c1-26-20(24)15-27-18-12-10-16(11-13-18)22-21(25)19-9-5-6-14-23(19)17-7-3-2-4-8-17;/h2-4,7-8,16,18-19H,5-6,9-15H2,1H3,(H,22,25);1H