ethyl 1-[2-oxidanyl-3-(4-propanoylphenoxy)propyl]piperidine-3-carboxylate hydrochloride

Systemtic Name: ethyl 1-[2-oxidanyl-3-(4-propanoylphenoxy)propyl]piperidine-3-carboxylate hydrochloride Openeye Name: ethyl 1-[2-hydroxy-3-(4-propanoylphenoxy)propyl]piperidine-3-carboxylate hydrochloride CAS Name: 1-[2-hydroxy-3-[4-(1-oxopropyl)phenoxy]propyl]-3-piperidinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 1-[2-hydroxy-3-(4-propanoylphenoxy)propyl]piperidine-3-carboxylate hydrochloride Traditional Name: 1-[2-hydroxy-3-(4-propionylphenoxy)propyl]nipecotic acid ethyl ester hydrochloride Formula: C20H30ClNO5 MolecularWeight: 399.9089

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(CN2CCCC(C2)C(=O)OCC)O.Cl

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(CN2CCCC(C2)C(=O)OCC)O.Cl

InChI

InChI=1S/C20H29NO5.ClH/c1-3-19(23)15-7-9-18(10-8-15)26-14-17(22)13-21-11-5-6-16(12-21)20(24)25-4-2;/h7-10,16-17,22H,3-6,11-14H2,1-2H3;1H