ethyl 4-[3-(2-methylpropyl)-4-oxidanylidene-phthalazin-1-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(2-methylpropyl)-4-oxidanylidene-phthalazin-1-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(3-isobutyl-4-oxo-phthalazine-1-carbonyl)piperazine-1-carboxylate CAS Name: 4-[[3-(2-methylpropyl)-4-oxo-1-phthalazinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(2-methylpropyl)-4-oxophthalazine-1-carbonyl]piperazine-1-carboxylate Traditional Name: 4-(3-isobutyl-4-keto-phthalazine-1-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C20H26N4O4/c1-4-28-20(27)23-11-9-22(10-12-23)19(26)17-15-7-5-6-8-16(15)18(25)24(21-17)13-14(2)3/h5-8,14H,4,9-13H2,1-3H3