2-azanyl-N-butyl-5-cyano-3-methyl-benzamide

Systemtic Name: 2-azanyl-N-butyl-5-cyano-3-methyl-benzamide Openeye Name: 2-amino-N-butyl-5-cyano-3-methyl-benzamide CAS Name: 2-amino-N-butyl-5-cyano-3-methylbenzamide IUPAC Name: 2-amino-N-butyl-5-cyano-3-methylbenzamide Traditional Name: 2-amino-N-butyl-5-cyano-3-methyl-benzamide Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O/c1-3-4-5-16-13(17)11-7-10(8-14)6-9(2)12(11)15/h6-7H,3-5,15H2,1-2H3,(H,16,17)