2-(benzotriazol-1-yl)-N-(2-chloranyl-5-methyl-phenyl)-4-(hydroxymethyl)-4-methyl-5-oxidanyl-3-oxidanylidene-pentanamide

Systemtic Name: 2-(benzotriazol-1-yl)-N-(2-chloranyl-5-methyl-phenyl)-4-(hydroxymethyl)-4-methyl-5-oxidanyl-3-oxidanylidene-pentanamide Openeye Name: 2-(benzotriazol-1-yl)-N-(2-chloro-5-methyl-phenyl)-5-hydroxy-4-(hydroxymethyl)-4-methyl-3-oxo-pentanamide CAS Name: 2-(1-benzotriazolyl)-N-(2-chloro-5-methylphenyl)-5-hydroxy-4-(hydroxymethyl)-4-methyl-3-oxopentanamide IUPAC Name: 2-(benzotriazol-1-yl)-N-(2-chloro-5-methylphenyl)-5-hydroxy-4-(hydroxymethyl)-4-methyl-3-oxopentanamide Traditional Name: 2-(benzotriazol-1-yl)-N-(2-chloro-5-methyl-phenyl)-5-hydroxy-3-keto-4-methyl-4-methylol-valeramide Formula: C20H21ClN4O4 MolecularWeight: 416.85814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C(C)(CO)CO)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C(C)(CO)CO)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C20H21ClN4O4/c1-12-7-8-13(21)15(9-12)22-19(29)17(18(28)20(2,10-26)11-27)25-16-6-4-3-5-14(16)23-24-25/h3-9,17,26-27H,10-11H2,1-2H3,(H,22,29)