3-[(4-methoxy-2-nitro-phenyl)-phenyl-amino]propanenitrile

Systemtic Name: 3-[(4-methoxy-2-nitro-phenyl)-phenyl-amino]propanenitrile Openeye Name: 3-(N-(4-methoxy-2-nitro-phenyl)anilino)propanenitrile CAS Name: 3-(N-(4-methoxy-2-nitrophenyl)anilino)propanenitrile IUPAC Name: 3-(N-(4-methoxy-2-nitrophenyl)anilino)propanenitrile Traditional Name: 3-(N-(4-methoxy-2-nitro-phenyl)anilino)propionitrile Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N(CCC#N)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)N(CCC#N)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O3/c1-22-14-8-9-15(16(12-14)19(20)21)18(11-5-10-17)13-6-3-2-4-7-13/h2-4,6-9,12H,5,11H2,1H3