2-[1-(3-nitrophenyl)propylamino]benzenecarbonitrile

Systemtic Name: 2-[1-(3-nitrophenyl)propylamino]benzenecarbonitrile Openeye Name: 2-[1-(3-nitrophenyl)propylamino]benzonitrile CAS Name: 2-[1-(3-nitrophenyl)propylamino]benzonitrile IUPAC Name: 2-[1-(3-nitrophenyl)propylamino]benzonitrile Traditional Name: 2-[1-(3-nitrophenyl)propylamino]benzonitrile Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)[N+](=O)[O-])NC2=CC=CC=C2C#N

Isomeric SMILES

CCC(C1=CC(=CC=C1)[N+](=O)[O-])NC2=CC=CC=C2C#N

InChI

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