3-[(5-methylhexan-2-ylamino)methyl]benzenecarbonitrile

Systemtic Name: 3-[(5-methylhexan-2-ylamino)methyl]benzenecarbonitrile Openeye Name: 3-[(1,4-dimethylpentylamino)methyl]benzonitrile CAS Name: 3-[(5-methylhexan-2-ylamino)methyl]benzonitrile IUPAC Name: 3-[(5-methylhexan-2-ylamino)methyl]benzonitrile Traditional Name: 3-[(1,4-dimethylpentylamino)methyl]benzonitrile Formula: C15H22N2 MolecularWeight: 230.34858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NCC1=CC=CC(=C1)C#N

Isomeric SMILES

CC(C)CCC(C)NCC1=CC=CC(=C1)C#N

InChI

InChI=1S/C15H22N2/c1-12(2)7-8-13(3)17-11-15-6-4-5-14(9-15)10-16/h4-6,9,12-13,17H,7-8,11H2,1-3H3