4-azanylbenzoic acid; ethyl 4-oxidanyl-1-propan-2-yl-piperidine-3-carboxylate; hydrochloride

Systemtic Name: 4-azanylbenzoic acid; ethyl 4-oxidanyl-1-propan-2-yl-piperidine-3-carboxylate; hydrochloride Openeye Name: 4-aminobenzoic acid; ethyl 4-hydroxy-1-isopropyl-piperidine-3-carboxylate; hydrochloride CAS Name: 4-aminobenzoic acid; 4-hydroxy-1-propan-2-yl-3-piperidinecarboxylic acid ethyl ester; hydrochloride IUPAC Name: 4-aminobenzoic acid; ethyl 4-hydroxy-1-propan-2-ylpiperidine-3-carboxylate; hydrochloride Traditional Name: 4-aminobenzoic acid; 4-hydroxy-1-isopropyl-nipecotic acid ethyl ester; hydrochloride Formula: C18H29ClN2O5 MolecularWeight: 388.88626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CN(CCC1O)C(C)C.C1=CC(=CC=C1C(=O)O)N.Cl

Isomeric SMILES

CCOC(=O)C1CN(CCC1O)C(C)C.C1=CC(=CC=C1C(=O)O)N.Cl

InChI

InChI=1S/C11H21NO3.C7H7NO2.ClH/c1-4-15-11(14)9-7-12(8(2)3)6-5-10(9)13;8-6-3-1-5(2-4-6)7(9)10;/h8-10,13H,4-7H2,1-3H3;1-4H,8H2,(H,9,10);1H