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

Systemtic Name: 4-azanylbenzoic acid; ethyl 4-oxidanyl-1-propyl-piperidine-3-carboxylate; hydrochloride Openeye Name: 4-aminobenzoic acid; ethyl 4-hydroxy-1-propyl-piperidine-3-carboxylate; hydrochloride CAS Name: 4-aminobenzoic acid; 4-hydroxy-1-propyl-3-piperidinecarboxylic acid ethyl ester; hydrochloride IUPAC Name: 4-aminobenzoic acid; ethyl 4-hydroxy-1-propylpiperidine-3-carboxylate; hydrochloride Traditional Name: 4-aminobenzoic acid; 4-hydroxy-1-propyl-nipecotic acid ethyl ester; hydrochloride Formula: C18H29ClN2O5 MolecularWeight: 388.88626

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(C(C1)C(=O)OCC)O.C1=CC(=CC=C1C(=O)O)N.Cl

Isomeric SMILES

CCCN1CCC(C(C1)C(=O)OCC)O.C1=CC(=CC=C1C(=O)O)N.Cl

InChI

InChI=1S/C11H21NO3.C7H7NO2.ClH/c1-3-6-12-7-5-10(13)9(8-12)11(14)15-4-2;8-6-3-1-5(2-4-6)7(9)10;/h9-10,13H,3-8H2,1-2H3;1-4H,8H2,(H,9,10);1H