6-[(4-chlorophenyl)methylamino]-5-nitro-pyridine-3-carbonitrile

Systemtic Name: 6-[(4-chlorophenyl)methylamino]-5-nitro-pyridine-3-carbonitrile Openeye Name: 6-[(4-chlorophenyl)methylamino]-5-nitro-pyridine-3-carbonitrile CAS Name: 6-[(4-chlorophenyl)methylamino]-5-nitro-3-pyridinecarbonitrile IUPAC Name: 6-[(4-chlorophenyl)methylamino]-5-nitropyridine-3-carbonitrile Traditional Name: 6-[(4-chlorobenzyl)amino]-5-nitro-nicotinonitrile Formula: C13H9ClN4O2 MolecularWeight: 288.68916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=C(C=C(C=N2)C#N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CNC2=C(C=C(C=N2)C#N)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H9ClN4O2/c14-11-3-1-9(2-4-11)7-16-13-12(18(19)20)5-10(6-15)8-17-13/h1-5,8H,7H2,(H,16,17)