1-[4-[(3-nitropyridin-4-yl)amino]phenyl]ethanone hydrochloride

Systemtic Name: 1-[4-[(3-nitropyridin-4-yl)amino]phenyl]ethanone hydrochloride Openeye Name: 1-[4-[(3-nitro-4-pyridyl)amino]phenyl]ethanone hydrochloride CAS Name: 1-[4-[(3-nitro-4-pyridinyl)amino]phenyl]ethanone hydrochloride IUPAC Name: 1-[4-[(3-nitropyridin-4-yl)amino]phenyl]ethanone hydrochloride Traditional Name: 1-[4-[(3-nitro-4-pyridyl)amino]phenyl]ethanone hydrochloride Formula: C13H12ClN3O3 MolecularWeight: 293.70568

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC2=C(C=NC=C2)[N+](=O)[O-].Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC2=C(C=NC=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C13H11N3O3.ClH/c1-9(17)10-2-4-11(5-3-10)15-12-6-7-14-8-13(12)16(18)19;/h2-8H,1H3,(H,14,15);1H