2-[[4-(2-ethoxyphenyl)piperazin-1-yl]methyl]-4-(4-methylphenyl)phthalazin-1-one

Systemtic Name: 2-[[4-(2-ethoxyphenyl)piperazin-1-yl]methyl]-4-(4-methylphenyl)phthalazin-1-one Openeye Name: 2-[[4-(2-ethoxyphenyl)piperazin-1-yl]methyl]-4-(p-tolyl)phthalazin-1-one CAS Name: 2-[[4-(2-ethoxyphenyl)-1-piperazinyl]methyl]-4-(4-methylphenyl)-1-phthalazinone IUPAC Name: 2-[[4-(2-ethoxyphenyl)piperazin-1-yl]methyl]-4-(4-methylphenyl)phthalazin-1-one Traditional Name: 2-[(4-o-phenetylpiperazino)methyl]-4-(p-tolyl)phthalazin-1-one Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)CN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=C(C=C5)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)CN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=C(C=C5)C

InChI

InChI=1S/C28H30N4O2/c1-3-34-26-11-7-6-10-25(26)31-18-16-30(17-19-31)20-32-28(33)24-9-5-4-8-23(24)27(29-32)22-14-12-21(2)13-15-22/h4-15H,3,16-20H2,1-2H3