3-[1-(3-nitrophenyl)propylamino]propanenitrile

Systemtic Name: 3-[1-(3-nitrophenyl)propylamino]propanenitrile Openeye Name: 3-[1-(3-nitrophenyl)propylamino]propanenitrile CAS Name: 3-[1-(3-nitrophenyl)propylamino]propanenitrile IUPAC Name: 3-[1-(3-nitrophenyl)propylamino]propanenitrile Traditional Name: 3-[1-(3-nitrophenyl)propylamino]propionitrile Formula: C12H15N3O2 MolecularWeight: 233.2664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O2/c1-2-12(14-8-4-7-13)10-5-3-6-11(9-10)15(16)17/h3,5-6,9,12,14H,2,4,8H2,1H3