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

Systemtic Name: ethyl 4-[(4-fluorophenyl)amino]-1-(phenylmethyl)piperidine-4-carboxylate dihydrochloride Openeye Name: ethyl 1-benzyl-4-(4-fluoroanilino)piperidine-4-carboxylate dihydrochloride CAS Name: 4-(4-fluoroanilino)-1-(phenylmethyl)-4-piperidinecarboxylic acid ethyl ester dihydrochloride IUPAC Name: ethyl 1-benzyl-4-(4-fluoroanilino)piperidine-4-carboxylate dihydrochloride Traditional Name: 1-benzyl-4-(4-fluoroanilino)isonipecotic acid ethyl ester dihydrochloride Formula: C21H27Cl2FN2O2 MolecularWeight: 429.355683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25FN2O2.2ClH/c1-2-26-20(25)21(23-19-10-8-18(22)9-11-19)12-14-24(15-13-21)16-17-6-4-3-5-7-17;;/h3-11,23H,2,12-16H2,1H3;2*1H