3-[[(4-ethyl-3-nitro-phenyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 3-[[(4-ethyl-3-nitro-phenyl)amino]methyl]benzenecarbonitrile Openeye Name: 3-[(4-ethyl-3-nitro-anilino)methyl]benzonitrile CAS Name: 3-[(4-ethyl-3-nitroanilino)methyl]benzonitrile IUPAC Name: 3-[(4-ethyl-3-nitroanilino)methyl]benzonitrile Traditional Name: 3-[(4-ethyl-3-nitro-anilino)methyl]benzonitrile Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NCC2=CC=CC(=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)NCC2=CC=CC(=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O2/c1-2-14-6-7-15(9-16(14)19(20)21)18-11-13-5-3-4-12(8-13)10-17/h3-9,18H,2,11H2,1H3