3-[(2-nitrophenyl)methyl-phenyl-amino]propanenitrile

Systemtic Name: 3-[(2-nitrophenyl)methyl-phenyl-amino]propanenitrile Openeye Name: 3-[N-[(2-nitrophenyl)methyl]anilino]propanenitrile CAS Name: 3-[N-[(2-nitrophenyl)methyl]anilino]propanenitrile IUPAC Name: 3-[N-[(2-nitrophenyl)methyl]anilino]propanenitrile Traditional Name: 3-(N-(2-nitrobenzyl)anilino)propionitrile Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O2/c17-11-6-12-18(15-8-2-1-3-9-15)13-14-7-4-5-10-16(14)19(20)21/h1-5,7-10H,6,12-13H2