2-azanyl-N-[4-(cyanomethyl)phenyl]-3-methyl-butanamide

Systemtic Name: 2-azanyl-N-[4-(cyanomethyl)phenyl]-3-methyl-butanamide Openeye Name: 2-amino-N-[4-(cyanomethyl)phenyl]-3-methyl-butanamide CAS Name: 2-amino-N-[4-(cyanomethyl)phenyl]-3-methylbutanamide IUPAC Name: 2-amino-N-[4-(cyanomethyl)phenyl]-3-methylbutanamide Traditional Name: 2-amino-N-[4-(cyanomethyl)phenyl]-3-methyl-butyramide Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O/c1-9(2)12(15)13(17)16-11-5-3-10(4-6-11)7-8-14/h3-6,9,12H,7,15H2,1-2H3,(H,16,17)