ethyl 4-[(4-methylphenyl)amino]-1-(phenylmethyl)piperidine-4-carboxylate dihydrochloride

Systemtic Name: ethyl 4-[(4-methylphenyl)amino]-1-(phenylmethyl)piperidine-4-carboxylate dihydrochloride Openeye Name: ethyl 1-benzyl-4-(4-methylanilino)piperidine-4-carboxylate dihydrochloride CAS Name: 4-(4-methylanilino)-1-(phenylmethyl)-4-piperidinecarboxylic acid ethyl ester dihydrochloride IUPAC Name: ethyl 1-benzyl-4-(4-methylanilino)piperidine-4-carboxylate dihydrochloride Traditional Name: 1-benzyl-4-(p-toluidino)isonipecotic acid ethyl ester dihydrochloride Formula: C22H30Cl2N2O2 MolecularWeight: 425.3918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=CC=CC=C2)NC3=CC=C(C=C3)C.Cl.Cl

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=CC=CC=C2)NC3=CC=C(C=C3)C.Cl.Cl

InChI

InChI=1S/C22H28N2O2.2ClH/c1-3-26-21(25)22(23-20-11-9-18(2)10-12-20)13-15-24(16-14-22)17-19-7-5-4-6-8-19;;/h4-12,23H,3,13-17H2,1-2H3;2*1H