[5-(nitrooxymethyl)pyridin-2-yl]methyl 2-acetyloxybenzoate hydrochloride

Systemtic Name: [5-(nitrooxymethyl)pyridin-2-yl]methyl 2-acetyloxybenzoate hydrochloride Openeye Name: [5-(nitrooxymethyl)-2-pyridyl]methyl 2-acetoxybenzoate hydrochloride CAS Name: 2-acetyloxybenzoic acid [5-(nitrooxymethyl)-2-pyridinyl]methyl ester hydrochloride IUPAC Name: [5-(nitrooxymethyl)pyridin-2-yl]methyl 2-acetyloxybenzoate hydrochloride Traditional Name: 2-acetoxybenzoic acid [5-(nitrooxymethyl)-2-pyridyl]methyl ester hydrochloride Formula: C16H15ClN2O7 MolecularWeight: 382.7525

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)OCC2=NC=C(C=C2)CO[N+](=O)[O-].Cl

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)OCC2=NC=C(C=C2)CO[N+](=O)[O-].Cl

InChI

InChI=1S/C16H14N2O7.ClH/c1-11(19)25-15-5-3-2-4-14(15)16(20)23-10-13-7-6-12(8-17-13)9-24-18(21)22;/h2-8H,9-10H2,1H3;1H