4-[4-(2,4-dimethylphenyl)carbonylpiperidin-1-yl]carbonyl-2-methyl-phthalazin-1-one

Systemtic Name: 4-[4-(2,4-dimethylphenyl)carbonylpiperidin-1-yl]carbonyl-2-methyl-phthalazin-1-one Openeye Name: 4-[4-(2,4-dimethylbenzoyl)piperidine-1-carbonyl]-2-methyl-phthalazin-1-one CAS Name: 4-[[4-[(2,4-dimethylphenyl)-oxomethyl]-1-piperidinyl]-oxomethyl]-2-methyl-1-phthalazinone IUPAC Name: 4-[4-(2,4-dimethylbenzoyl)piperidine-1-carbonyl]-2-methylphthalazin-1-one Traditional Name: 4-[4-(2,4-dimethylbenzoyl)piperidine-1-carbonyl]-2-methyl-phthalazin-1-one Formula: C24H25N3O3 MolecularWeight: 403.4736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)C2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)C2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C)C

InChI

InChI=1S/C24H25N3O3/c1-15-8-9-18(16(2)14-15)22(28)17-10-12-27(13-11-17)24(30)21-19-6-4-5-7-20(19)23(29)26(3)25-21/h4-9,14,17H,10-13H2,1-3H3