4-(4-methylphenyl)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)phthalazin-1-one

Systemtic Name: 4-(4-methylphenyl)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)phthalazin-1-one Openeye Name: 2-(2-oxo-2-pyrrolidin-1-yl-ethyl)-4-(p-tolyl)phthalazin-1-one CAS Name: 4-(4-methylphenyl)-2-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-phthalazinone IUPAC Name: 4-(4-methylphenyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)phthalazin-1-one Traditional Name: 2-(2-keto-2-pyrrolidino-ethyl)-4-(p-tolyl)phthalazin-1-one Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)N4CCCC4

InChI

InChI=1S/C21H21N3O2/c1-15-8-10-16(11-9-15)20-17-6-2-3-7-18(17)21(26)24(22-20)14-19(25)23-12-4-5-13-23/h2-3,6-11H,4-5,12-14H2,1H3