2-[3-[2-tert-butyl-6-(cyanoamino)pyridin-4-yl]propanoylamino]-N-oxidanyl-benzeneamine oxide

Systemtic Name: 2-[3-[2-tert-butyl-6-(cyanoamino)pyridin-4-yl]propanoylamino]-N-oxidanyl-benzeneamine oxide Openeye Name: 2-[3-[2-tert-butyl-6-(cyanoamino)-4-pyridyl]propanoylamino]-N-hydroxy-benzeneamine oxide CAS Name: 2-[[3-[2-tert-butyl-6-(cyanoamino)-4-pyridinyl]-1-oxopropyl]amino]-N-hydroxybenzeneamine oxide IUPAC Name: 2-[3-[2-tert-butyl-6-(cyanoamino)pyridin-4-yl]propanoylamino]-N-hydroxybenzeneamine oxide Traditional Name: 2-[3-[2-tert-butyl-6-(cyanoamino)-4-pyridyl]propanoylamino]-N-hydroxy-benzeneamine oxide Formula: C19H23N5O3 MolecularWeight: 369.41762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=CC(=C1)CCC(=O)NC2=CC=CC=C2[NH+](O)[O-])NC#N

Isomeric SMILES

CC(C)(C)C1=NC(=CC(=C1)CCC(=O)NC2=CC=CC=C2[NH+](O)[O-])NC#N

InChI

InChI=1S/C19H23N5O3/c1-19(2,3)16-10-13(11-17(23-16)21-12-20)8-9-18(25)22-14-6-4-5-7-15(14)24(26)27/h4-7,10-11,24,26H,8-9H2,1-3H3,(H,21,23)(H,22,25)