N-[3-(aminomethyl)phenyl]-3-nitro-pyridin-2-amine hydrochloride

Systemtic Name: N-[3-(aminomethyl)phenyl]-3-nitro-pyridin-2-amine hydrochloride Openeye Name: N-[3-(aminomethyl)phenyl]-3-nitro-pyridin-2-amine hydrochloride CAS Name: N-[3-(aminomethyl)phenyl]-3-nitro-2-pyridinamine hydrochloride IUPAC Name: N-[3-(aminomethyl)phenyl]-3-nitropyridin-2-amine hydrochloride Traditional Name: [3-(aminomethyl)phenyl]-(3-nitro-2-pyridyl)amine hydrochloride Formula: C12H13ClN4O2 MolecularWeight: 280.71022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=C(C=CC=N2)[N+](=O)[O-])CN.Cl

Isomeric SMILES

C1=CC(=CC(=C1)NC2=C(C=CC=N2)[N+](=O)[O-])CN.Cl

InChI

InChI=1S/C12H12N4O2.ClH/c13-8-9-3-1-4-10(7-9)15-12-11(16(17)18)5-2-6-14-12;/h1-7H,8,13H2,(H,14,15);1H