methyl 4-[cyclopropylcarbonyl(phenyl)amino]-1-phenethyl-piperidine-4-carboxylate hydrochloride

Systemtic Name: methyl 4-[cyclopropylcarbonyl(phenyl)amino]-1-phenethyl-piperidine-4-carboxylate hydrochloride Openeye Name: methyl 4-[N-(cyclopropanecarbonyl)anilino]-1-phenethyl-piperidine-4-carboxylate hydrochloride CAS Name: 4-(N-[cyclopropyl(oxo)methyl]anilino)-1-phenethyl-4-piperidinecarboxylic acid methyl ester hydrochloride IUPAC Name: methyl 4-[N-(cyclopropanecarbonyl)anilino]-1-phenethylpiperidine-4-carboxylate hydrochloride Traditional Name: 4-[N-(cyclopropanecarbonyl)anilino]-1-phenethyl-isonipecotic acid methyl ester hydrochloride Formula: C25H31ClN2O3 MolecularWeight: 442.97824

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCN(CC1)CCC2=CC=CC=C2)N(C3=CC=CC=C3)C(=O)C4CC4.Cl

Isomeric SMILES

COC(=O)C1(CCN(CC1)CCC2=CC=CC=C2)N(C3=CC=CC=C3)C(=O)C4CC4.Cl

InChI

InChI=1S/C25H30N2O3.ClH/c1-30-24(29)25(27(23(28)21-12-13-21)22-10-6-3-7-11-22)15-18-26(19-16-25)17-14-20-8-4-2-5-9-20;/h2-11,21H,12-19H2,1H3;1H