4-(2,5-dimethylphenyl)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)phthalazin-1-one

Systemtic Name: 4-(2,5-dimethylphenyl)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)phthalazin-1-one Openeye Name: 4-(2,5-dimethylphenyl)-2-[2-oxo-2-(1-piperidyl)ethyl]phthalazin-1-one CAS Name: 4-(2,5-dimethylphenyl)-2-[2-oxo-2-(1-piperidinyl)ethyl]-1-phthalazinone IUPAC Name: 4-(2,5-dimethylphenyl)-2-(2-oxo-2-piperidin-1-ylethyl)phthalazin-1-one Traditional Name: 4-(2,5-dimethylphenyl)-2-(2-keto-2-piperidino-ethyl)phthalazin-1-one Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)N4CCCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)N4CCCCC4

InChI

InChI=1S/C23H25N3O2/c1-16-10-11-17(2)20(14-16)22-18-8-4-5-9-19(18)23(28)26(24-22)15-21(27)25-12-6-3-7-13-25/h4-5,8-11,14H,3,6-7,12-13,15H2,1-2H3