N-[2-(2-methoxyphenyl)ethyl]-4-[4-(4-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide

Systemtic Name: N-[2-(2-methoxyphenyl)ethyl]-4-[4-(4-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide Openeye Name: N-[2-(2-methoxyphenyl)ethyl]-4-[4-(4-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide CAS Name: N-[2-(2-methoxyphenyl)ethyl]-4-[4-(4-methoxyphenyl)-1-piperazinyl]-1-phthalazinecarboxamide IUPAC Name: N-[2-(2-methoxyphenyl)ethyl]-4-[4-(4-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide Traditional Name: N-[2-(2-methoxyphenyl)ethyl]-4-[4-(4-methoxyphenyl)piperazino]phthalazine-1-carboxamide Formula: C29H31N5O3 MolecularWeight: 497.58814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)NCCC5=CC=CC=C5OC

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)NCCC5=CC=CC=C5OC

InChI

InChI=1S/C29H31N5O3/c1-36-23-13-11-22(12-14-23)33-17-19-34(20-18-33)28-25-9-5-4-8-24(25)27(31-32-28)29(35)30-16-15-21-7-3-6-10-26(21)37-2/h3-14H,15-20H2,1-2H3,(H,30,35)