4-azanylbenzoic acid; ethyl 1-ethyl-4-oxidanyl-piperidine-3-carboxylate; hydrochloride

Systemtic Name: 4-azanylbenzoic acid; ethyl 1-ethyl-4-oxidanyl-piperidine-3-carboxylate; hydrochloride Openeye Name: 4-aminobenzoic acid; ethyl 1-ethyl-4-hydroxy-piperidine-3-carboxylate; hydrochloride CAS Name: 4-aminobenzoic acid; 1-ethyl-4-hydroxy-3-piperidinecarboxylic acid ethyl ester; hydrochloride IUPAC Name: 4-aminobenzoic acid; ethyl 1-ethyl-4-hydroxypiperidine-3-carboxylate; hydrochloride Traditional Name: 4-aminobenzoic acid; 1-ethyl-4-hydroxy-nipecotic acid ethyl ester; hydrochloride Formula: C17H27ClN2O5 MolecularWeight: 374.85968

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(C(C1)C(=O)OCC)O.C1=CC(=CC=C1C(=O)O)N.Cl

Isomeric SMILES

CCN1CCC(C(C1)C(=O)OCC)O.C1=CC(=CC=C1C(=O)O)N.Cl

InChI

InChI=1S/C10H19NO3.C7H7NO2.ClH/c1-3-11-6-5-9(12)8(7-11)10(13)14-4-2;8-6-3-1-5(2-4-6)7(9)10;/h8-9,12H,3-7H2,1-2H3;1-4H,8H2,(H,9,10);1H