2-methyl-3-[4-[(1-phenylpiperidin-2-yl)carbonylamino]cyclohexyl]propanoic acid hydrochloride

Systemtic Name: 2-methyl-3-[4-[(1-phenylpiperidin-2-yl)carbonylamino]cyclohexyl]propanoic acid hydrochloride Openeye Name: 2-methyl-3-[4-[(1-phenylpiperidine-2-carbonyl)amino]cyclohexyl]propanoic acid hydrochloride CAS Name: 2-methyl-3-[4-[[oxo-(1-phenyl-2-piperidinyl)methyl]amino]cyclohexyl]propanoic acid hydrochloride IUPAC Name: 2-methyl-3-[4-[(1-phenylpiperidine-2-carbonyl)amino]cyclohexyl]propanoic acid hydrochloride Traditional Name: 2-methyl-3-[4-[(1-phenylpipecoloyl)amino]cyclohexyl]propionic acid hydrochloride Formula: C22H33ClN2O3 MolecularWeight: 408.96202

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1CCC(CC1)NC(=O)C2CCCCN2C3=CC=CC=C3)C(=O)O.Cl

Isomeric SMILES

CC(CC1CCC(CC1)NC(=O)C2CCCCN2C3=CC=CC=C3)C(=O)O.Cl

InChI

InChI=1S/C22H32N2O3.ClH/c1-16(22(26)27)15-17-10-12-18(13-11-17)23-21(25)20-9-5-6-14-24(20)19-7-3-2-4-8-19;/h2-4,7-8,16-18,20H,5-6,9-15H2,1H3,(H,23,25)(H,26,27);1H