hexyl 2-oxidanyl-4-(3-piperidin-1-ylpropanoylamino)benzoate hydrochloride

Systemtic Name: hexyl 2-oxidanyl-4-(3-piperidin-1-ylpropanoylamino)benzoate hydrochloride Openeye Name: hexyl 2-hydroxy-4-[3-(1-piperidyl)propanoylamino]benzoate hydrochloride CAS Name: 2-hydroxy-4-[[1-oxo-3-(1-piperidinyl)propyl]amino]benzoic acid hexyl ester hydrochloride IUPAC Name: hexyl 2-hydroxy-4-(3-piperidin-1-ylpropanoylamino)benzoate hydrochloride Traditional Name: 2-hydroxy-4-(3-piperidinopropanoylamino)benzoic acid hexyl ester hydrochloride Formula: C21H33ClN2O4 MolecularWeight: 412.95072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=C(C=C(C=C1)NC(=O)CCN2CCCCC2)O.Cl

Isomeric SMILES

CCCCCCOC(=O)C1=C(C=C(C=C1)NC(=O)CCN2CCCCC2)O.Cl

InChI

InChI=1S/C21H32N2O4.ClH/c1-2-3-4-8-15-27-21(26)18-10-9-17(16-19(18)24)22-20(25)11-14-23-12-6-5-7-13-23;/h9-10,16,24H,2-8,11-15H2,1H3,(H,22,25);1H