4-[cyano-(propan-2-ylamino)methyl]benzenecarbonitrile

Systemtic Name: 4-[cyano-(propan-2-ylamino)methyl]benzenecarbonitrile Openeye Name: 4-[cyano-(isopropylamino)methyl]benzonitrile CAS Name: 4-[cyano-(propan-2-ylamino)methyl]benzonitrile IUPAC Name: 4-[cyano-(propan-2-ylamino)methyl]benzonitrile Traditional Name: 4-[cyano-(isopropylamino)methyl]benzonitrile Formula: C12H13N3 MolecularWeight: 199.25172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(C#N)C1=CC=C(C=C1)C#N

Isomeric SMILES

CC(C)NC(C#N)C1=CC=C(C=C1)C#N

InChI

InChI=1S/C12H13N3/c1-9(2)15-12(8-14)11-5-3-10(7-13)4-6-11/h3-6,9,12,15H,1-2H3