5-(2-isoquinolin-1-ylcarbonylhydrazinyl)-3,3-dimethyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(2-isoquinolin-1-ylcarbonylhydrazinyl)-3,3-dimethyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-[2-(isoquinoline-1-carbonyl)hydrazino]-3,3-dimethyl-5-oxo-pentanoic acid CAS Name: 5-[[1-isoquinolinyl(oxo)methyl]hydrazo]-3,3-dimethyl-5-oxopentanoic acid IUPAC Name: 5-[2-(isoquinoline-1-carbonyl)hydrazinyl]-3,3-dimethyl-5-oxopentanoic acid Traditional Name: 5-[N'-(isoquinoline-1-carbonyl)hydrazino]-5-keto-3,3-dimethyl-valeric acid Formula: C17H19N3O4 MolecularWeight: 329.35046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NNC(=O)C1=NC=CC2=CC=CC=C21)CC(=O)O

Isomeric SMILES

CC(C)(CC(=O)NNC(=O)C1=NC=CC2=CC=CC=C21)CC(=O)O

InChI

InChI=1S/C17H19N3O4/c1-17(2,10-14(22)23)9-13(21)19-20-16(24)15-12-6-4-3-5-11(12)7-8-18-15/h3-8H,9-10H2,1-2H3,(H,19,21)(H,20,24)(H,22,23)