2-piperidin-2-ylethyl 3-nitrobenzoate hydrochloride

Systemtic Name: 2-piperidin-2-ylethyl 3-nitrobenzoate hydrochloride Openeye Name: 2-(2-piperidyl)ethyl 3-nitrobenzoate hydrochloride CAS Name: 3-nitrobenzoic acid 2-(2-piperidinyl)ethyl ester hydrochloride IUPAC Name: 2-piperidin-2-ylethyl 3-nitrobenzoate hydrochloride Traditional Name: 3-nitrobenzoic acid 2-(2-piperidyl)ethyl ester hydrochloride Formula: C14H19ClN2O4 MolecularWeight: 314.76466

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(C1)CCOC(=O)C2=CC(=CC=C2)[N+](=O)[O-].Cl

Isomeric SMILES

C1CCNC(C1)CCOC(=O)C2=CC(=CC=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C14H18N2O4.ClH/c17-14(11-4-3-6-13(10-11)16(18)19)20-9-7-12-5-1-2-8-15-12;/h3-4,6,10,12,15H,1-2,5,7-9H2;1H