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

Systemtic Name: ethyl 4-[3-(4-ethoxyphenyl)-4-oxidanylidene-phthalazin-1-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[3-(4-ethoxyphenyl)-4-oxo-phthalazine-1-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[3-(4-ethoxyphenyl)-4-oxo-1-phthalazinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-ethoxyphenyl)-4-oxophthalazine-1-carbonyl]piperazine-1-carboxylate Traditional Name: 4-(4-keto-3-p-phenetyl-phthalazine-1-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C24H26N4O5 MolecularWeight: 450.48704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)N4CCN(CC4)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)N4CCN(CC4)C(=O)OCC

InChI

InChI=1S/C24H26N4O5/c1-3-32-18-11-9-17(10-12-18)28-22(29)20-8-6-5-7-19(20)21(25-28)23(30)26-13-15-27(16-14-26)24(31)33-4-2/h5-12H,3-4,13-16H2,1-2H3