N-[(2-chloranyl-5-nitro-phenyl)methyl]-1-pyridin-3-yl-methanamine

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-1-pyridin-3-yl-methanamine Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-1-(3-pyridyl)methanamine CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-1-(3-pyridinyl)methanamine IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-1-pyridin-3-ylmethanamine Traditional Name: (2-chloro-5-nitro-benzyl)-(3-pyridylmethyl)amine Formula: C13H12ClN3O2 MolecularWeight: 277.70628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CN=C1)CNCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H12ClN3O2/c14-13-4-3-12(17(18)19)6-11(13)9-16-8-10-2-1-5-15-7-10/h1-7,16H,8-9H2