ethyl 1-pentyl-4-(phenylcarbonyloxy)piperidine-3-carboxylate hydrochloride

Systemtic Name: ethyl 1-pentyl-4-(phenylcarbonyloxy)piperidine-3-carboxylate hydrochloride Openeye Name: ethyl 4-benzoyloxy-1-pentyl-piperidine-3-carboxylate hydrochloride CAS Name: 4-benzoyloxy-1-pentyl-3-piperidinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-benzoyloxy-1-pentylpiperidine-3-carboxylate hydrochloride Traditional Name: 1-amyl-4-benzoyloxy-nipecotic acid ethyl ester hydrochloride Formula: C20H30ClNO4 MolecularWeight: 383.9095

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CCC(C(C1)C(=O)OCC)OC(=O)C2=CC=CC=C2.Cl

Isomeric SMILES

CCCCCN1CCC(C(C1)C(=O)OCC)OC(=O)C2=CC=CC=C2.Cl

InChI

InChI=1S/C20H29NO4.ClH/c1-3-5-9-13-21-14-12-18(17(15-21)20(23)24-4-2)25-19(22)16-10-7-6-8-11-16;/h6-8,10-11,17-18H,3-5,9,12-15H2,1-2H3;1H