3-piperidin-1-ylpentyl 4-nitrobenzoate hydrochloride

Systemtic Name: 3-piperidin-1-ylpentyl 4-nitrobenzoate hydrochloride Openeye Name: 3-(1-piperidyl)pentyl 4-nitrobenzoate hydrochloride CAS Name: 4-nitrobenzoic acid 3-(1-piperidinyl)pentyl ester hydrochloride IUPAC Name: 3-piperidin-1-ylpentyl 4-nitrobenzoate hydrochloride Traditional Name: 4-nitrobenzoic acid 3-piperidinopentyl ester hydrochloride Formula: C17H25ClN2O4 MolecularWeight: 356.8444

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-])N2CCCCC2.Cl

Isomeric SMILES

CCC(CCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-])N2CCCCC2.Cl

InChI

InChI=1S/C17H24N2O4.ClH/c1-2-15(18-11-4-3-5-12-18)10-13-23-17(20)14-6-8-16(9-7-14)19(21)22;/h6-9,15H,2-5,10-13H2,1H3;1H