2-[3-(3-methylbutyl)-4-oxidanylidene-phthalazin-1-yl]ethanoic acid

Systemtic Name: 2-[3-(3-methylbutyl)-4-oxidanylidene-phthalazin-1-yl]ethanoic acid Openeye Name: 2-(3-isopentyl-4-oxo-phthalazin-1-yl)acetic acid CAS Name: 2-[3-(3-methylbutyl)-4-oxo-1-phthalazinyl]acetic acid IUPAC Name: 2-[3-(3-methylbutyl)-4-oxophthalazin-1-yl]acetic acid Traditional Name: 2-(3-isoamyl-4-keto-phthalazin-1-yl)acetic acid Formula: C15H18N2O3 MolecularWeight: 274.31502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)O

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)O

InChI

InChI=1S/C15H18N2O3/c1-10(2)7-8-17-15(20)12-6-4-3-5-11(12)13(16-17)9-14(18)19/h3-6,10H,7-9H2,1-2H3,(H,18,19)