3-[(3-methyl-4-nitro-phenyl)-phenyl-amino]propanenitrile

Systemtic Name: 3-[(3-methyl-4-nitro-phenyl)-phenyl-amino]propanenitrile Openeye Name: 3-(N-(3-methyl-4-nitro-phenyl)anilino)propanenitrile CAS Name: 3-(N-(3-methyl-4-nitrophenyl)anilino)propanenitrile IUPAC Name: 3-(N-(3-methyl-4-nitrophenyl)anilino)propanenitrile Traditional Name: 3-(N-(3-methyl-4-nitro-phenyl)anilino)propionitrile Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(CCC#N)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)N(CCC#N)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O2/c1-13-12-15(8-9-16(13)19(20)21)18(11-5-10-17)14-6-3-2-4-7-14/h2-4,6-9,12H,5,11H2,1H3