(E)-3-[3-[(3-nitropyridin-2-yl)amino]phenyl]prop-2-enenitrile

Systemtic Name: (E)-3-[3-[(3-nitropyridin-2-yl)amino]phenyl]prop-2-enenitrile Openeye Name: (E)-3-[3-[(3-nitro-2-pyridyl)amino]phenyl]prop-2-enenitrile CAS Name: (E)-3-[3-[(3-nitro-2-pyridinyl)amino]phenyl]-2-propenenitrile IUPAC Name: (E)-3-[3-[(3-nitropyridin-2-yl)amino]phenyl]prop-2-enenitrile Traditional Name: (E)-3-[3-[(3-nitro-2-pyridyl)amino]phenyl]acrylonitrile Formula: C14H10N4O2 MolecularWeight: 266.2548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=C(C=CC=N2)[N+](=O)[O-])C=CC#N

Isomeric SMILES

C1=CC(=CC(=C1)NC2=C(C=CC=N2)[N+](=O)[O-])/C=C/C#N

InChI

InChI=1S/C14H10N4O2/c15-8-2-5-11-4-1-6-12(10-11)17-14-13(18(19)20)7-3-9-16-14/h1-7,9-10H,(H,16,17)/b5-2+