2-(3-methoxyphenyl)-4-(3-methylpiperidin-1-yl)carbonyl-phthalazin-1-one

Systemtic Name: 2-(3-methoxyphenyl)-4-(3-methylpiperidin-1-yl)carbonyl-phthalazin-1-one Openeye Name: 2-(3-methoxyphenyl)-4-(3-methylpiperidine-1-carbonyl)phthalazin-1-one CAS Name: 2-(3-methoxyphenyl)-4-[(3-methyl-1-piperidinyl)-oxomethyl]-1-phthalazinone IUPAC Name: 2-(3-methoxyphenyl)-4-(3-methylpiperidine-1-carbonyl)phthalazin-1-one Traditional Name: 2-(3-methoxyphenyl)-4-(3-methylpiperidine-1-carbonyl)phthalazin-1-one Formula: C22H23N3O3 MolecularWeight: 377.43632

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O3/c1-15-7-6-12-24(14-15)22(27)20-18-10-3-4-11-19(18)21(26)25(23-20)16-8-5-9-17(13-16)28-2/h3-5,8-11,13,15H,6-7,12,14H2,1-2H3