5-(cycloheptylamino)-N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]pentanamide hydrochloride

Systemtic Name: 5-(cycloheptylamino)-N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]pentanamide hydrochloride Openeye Name: 5-(cycloheptylamino)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]pentanamide hydrochloride CAS Name: 5-(cycloheptylamino)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]pentanamide hydrochloride IUPAC Name: 5-(cycloheptylamino)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]pentanamide hydrochloride Traditional Name: 5-(cycloheptylamino)-N-[3-(4-keto-3H-phthalazin-1-yl)phenyl]valeramide hydrochloride Formula: C26H33ClN4O2 MolecularWeight: 469.01882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NCCCCC(=O)NC2=CC=CC(=C2)C3=NNC(=O)C4=CC=CC=C43.Cl

Isomeric SMILES

C1CCCC(CC1)NCCCCC(=O)NC2=CC=CC(=C2)C3=NNC(=O)C4=CC=CC=C43.Cl

InChI

InChI=1S/C26H32N4O2.ClH/c31-24(16-7-8-17-27-20-11-3-1-2-4-12-20)28-21-13-9-10-19(18-21)25-22-14-5-6-15-23(22)26(32)30-29-25;/h5-6,9-10,13-15,18,20,27H,1-4,7-8,11-12,16-17H2,(H,28,31)(H,30,32);1H