2-azanyl-5-[2-(butan-2-ylamino)ethanoyl]benzene-1,3-dicarbonitrile

Systemtic Name: 2-azanyl-5-[2-(butan-2-ylamino)ethanoyl]benzene-1,3-dicarbonitrile Openeye Name: 2-amino-5-[2-(sec-butylamino)acetyl]benzene-1,3-dicarbonitrile CAS Name: 2-amino-5-[2-(butan-2-ylamino)-1-oxoethyl]benzene-1,3-dicarbonitrile IUPAC Name: 2-amino-5-[2-(butan-2-ylamino)acetyl]benzene-1,3-dicarbonitrile Traditional Name: 2-amino-5-[2-(sec-butylamino)acetyl]isophthalonitrile Formula: C14H16N4O MolecularWeight: 256.30304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCC(=O)C1=CC(=C(C(=C1)C#N)N)C#N

Isomeric SMILES

CCC(C)NCC(=O)C1=CC(=C(C(=C1)C#N)N)C#N

InChI

InChI=1S/C14H16N4O/c1-3-9(2)18-8-13(19)10-4-11(6-15)14(17)12(5-10)7-16/h4-5,9,18H,3,8,17H2,1-2H3