2-(3,5-dimethoxyphenyl)-4-(3-methylpiperidin-1-yl)carbonyl-phthalazin-1-one

Systemtic Name: 2-(3,5-dimethoxyphenyl)-4-(3-methylpiperidin-1-yl)carbonyl-phthalazin-1-one Openeye Name: 2-(3,5-dimethoxyphenyl)-4-(3-methylpiperidine-1-carbonyl)phthalazin-1-one CAS Name: 2-(3,5-dimethoxyphenyl)-4-[(3-methyl-1-piperidinyl)-oxomethyl]-1-phthalazinone IUPAC Name: 2-(3,5-dimethoxyphenyl)-4-(3-methylpiperidine-1-carbonyl)phthalazin-1-one Traditional Name: 2-(3,5-dimethoxyphenyl)-4-(3-methylpiperidine-1-carbonyl)phthalazin-1-one Formula: C23H25N3O4 MolecularWeight: 407.4623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=CC(=C4)OC)OC

Isomeric SMILES

CC1CCCN(C1)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=CC(=C4)OC)OC

InChI

InChI=1S/C23H25N3O4/c1-15-7-6-10-25(14-15)23(28)21-19-8-4-5-9-20(19)22(27)26(24-21)16-11-17(29-2)13-18(12-16)30-3/h4-5,8-9,11-13,15H,6-7,10,14H2,1-3H3