1-[3-[(3-nitropyridin-2-yl)amino]phenyl]pyrrole-2-carbonitrile

Systemtic Name: 1-[3-[(3-nitropyridin-2-yl)amino]phenyl]pyrrole-2-carbonitrile Openeye Name: 1-[3-[(3-nitro-2-pyridyl)amino]phenyl]pyrrole-2-carbonitrile CAS Name: 1-[3-[(3-nitro-2-pyridinyl)amino]phenyl]-2-pyrrolecarbonitrile IUPAC Name: 1-[3-[(3-nitropyridin-2-yl)amino]phenyl]pyrrole-2-carbonitrile Traditional Name: 1-[3-[(3-nitro-2-pyridyl)amino]phenyl]pyrrole-2-carbonitrile Formula: C16H11N5O2 MolecularWeight: 305.29084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=C(C=CC=N2)[N+](=O)[O-])N3C=CC=C3C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC2=C(C=CC=N2)[N+](=O)[O-])N3C=CC=C3C#N

InChI

InChI=1S/C16H11N5O2/c17-11-14-6-3-9-20(14)13-5-1-4-12(10-13)19-16-15(21(22)23)7-2-8-18-16/h1-10H,(H,18,19)