1-[4-[4-(3,4-dimethoxyphenyl)-1-oxidanylidene-4a,5,6,7,8,8a-hexahydrophthalazin-2-yl]piperidin-1-yl]carbonyl-4-ethyl-piperazine-2,3-dione

Systemtic Name: 1-[4-[4-(3,4-dimethoxyphenyl)-1-oxidanylidene-4a,5,6,7,8,8a-hexahydrophthalazin-2-yl]piperidin-1-yl]carbonyl-4-ethyl-piperazine-2,3-dione Openeye Name: 1-[4-[4-(3,4-dimethoxyphenyl)-1-oxo-4a,5,6,7,8,8a-hexahydrophthalazin-2-yl]piperidine-1-carbonyl]-4-ethyl-piperazine-2,3-dione CAS Name: 1-[[4-[4-(3,4-dimethoxyphenyl)-1-oxo-4a,5,6,7,8,8a-hexahydrophthalazin-2-yl]-1-piperidinyl]-oxomethyl]-4-ethylpiperazine-2,3-dione IUPAC Name: 1-[4-[4-(3,4-dimethoxyphenyl)-1-oxo-4a,5,6,7,8,8a-hexahydrophthalazin-2-yl]piperidine-1-carbonyl]-4-ethylpiperazine-2,3-dione Traditional Name: 1-[4-[4-(3,4-dimethoxyphenyl)-1-keto-4a,5,6,7,8,8a-hexahydrophthalazin-2-yl]piperidine-1-carbonyl]-4-ethyl-piperazine-2,3-quinone Formula: C28H37N5O6 MolecularWeight: 539.62328

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(C(=O)C1=O)C(=O)N2CCC(CC2)N3C(=O)C4CCCCC4C(=N3)C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

CCN1CCN(C(=O)C1=O)C(=O)N2CCC(CC2)N3C(=O)C4CCCCC4C(=N3)C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C28H37N5O6/c1-4-30-15-16-32(27(36)26(30)35)28(37)31-13-11-19(12-14-31)33-25(34)21-8-6-5-7-20(21)24(29-33)18-9-10-22(38-2)23(17-18)39-3/h9-10,17,19-21H,4-8,11-16H2,1-3H3