(6-methyl-5-oxidanyl-pyridin-3-yl)methyl 4-nitrobenzoate hydrochloride

Systemtic Name: (6-methyl-5-oxidanyl-pyridin-3-yl)methyl 4-nitrobenzoate hydrochloride Openeye Name: (5-hydroxy-6-methyl-3-pyridyl)methyl 4-nitrobenzoate hydrochloride CAS Name: 4-nitrobenzoic acid (5-hydroxy-6-methyl-3-pyridinyl)methyl ester hydrochloride IUPAC Name: (5-hydroxy-6-methylpyridin-3-yl)methyl 4-nitrobenzoate hydrochloride Traditional Name: 4-nitrobenzoic acid (5-hydroxy-6-methyl-3-pyridyl)methyl ester hydrochloride Formula: C14H13ClN2O5 MolecularWeight: 324.71642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=N1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])O.Cl

Isomeric SMILES

CC1=C(C=C(C=N1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])O.Cl

InChI

InChI=1S/C14H12N2O5.ClH/c1-9-13(17)6-10(7-15-9)8-21-14(18)11-2-4-12(5-3-11)16(19)20;/h2-7,17H,8H2,1H3;1H