2-[2-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]phthalazin-1-one

Systemtic Name: 2-[2-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]phthalazin-1-one Openeye Name: 2-[2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-2-oxo-ethyl]phthalazin-1-one CAS Name: 2-[2-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-2-oxoethyl]-1-phthalazinone IUPAC Name: 2-[2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-2-oxoethyl]phthalazin-1-one Traditional Name: 2-[2-keto-2-(4-veratroylpiperazino)ethyl]phthalazin-1-one Formula: C23H24N4O5 MolecularWeight: 436.46046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)CN3C(=O)C4=CC=CC=C4C=N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)CN3C(=O)C4=CC=CC=C4C=N3)OC

InChI

InChI=1S/C23H24N4O5/c1-31-19-8-7-16(13-20(19)32-2)22(29)26-11-9-25(10-12-26)21(28)15-27-23(30)18-6-4-3-5-17(18)14-24-27/h3-8,13-14H,9-12,15H2,1-2H3