3-[(3-propan-2-ylphenyl)amino]pentanenitrile

Systemtic Name: 3-[(3-propan-2-ylphenyl)amino]pentanenitrile Openeye Name: 3-(3-isopropylanilino)pentanenitrile CAS Name: 3-(3-propan-2-ylanilino)pentanenitrile IUPAC Name: 3-(3-propan-2-ylanilino)pentanenitrile Traditional Name: 3-(3-isopropylanilino)valeronitrile Formula: C14H20N2 MolecularWeight: 216.322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)NC1=CC=CC(=C1)C(C)C

Isomeric SMILES

CCC(CC#N)NC1=CC=CC(=C1)C(C)C

InChI

InChI=1S/C14H20N2/c1-4-13(8-9-15)16-14-7-5-6-12(10-14)11(2)3/h5-7,10-11,13,16H,4,8H2,1-3H3