4-methyl-2-(4-piperidin-1-ylcarbonylphenyl)phthalazin-1-one

Systemtic Name: 4-methyl-2-(4-piperidin-1-ylcarbonylphenyl)phthalazin-1-one Openeye Name: 4-methyl-2-[4-(piperidine-1-carbonyl)phenyl]phthalazin-1-one CAS Name: 4-methyl-2-[4-[oxo(1-piperidinyl)methyl]phenyl]-1-phthalazinone IUPAC Name: 4-methyl-2-[4-(piperidine-1-carbonyl)phenyl]phthalazin-1-one Traditional Name: 4-methyl-2-[4-(piperidine-1-carbonyl)phenyl]phthalazin-1-one Formula: C21H21N3O2 MolecularWeight: 347.41034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)C3=CC=C(C=C3)C(=O)N4CCCCC4

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)C3=CC=C(C=C3)C(=O)N4CCCCC4

InChI

InChI=1S/C21H21N3O2/c1-15-18-7-3-4-8-19(18)21(26)24(22-15)17-11-9-16(10-12-17)20(25)23-13-5-2-6-14-23/h3-4,7-12H,2,5-6,13-14H2,1H3