4-(4-methylphenyl)-2-[4-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]butyl]phthalazin-1-one

Systemtic Name: 4-(4-methylphenyl)-2-[4-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]butyl]phthalazin-1-one Openeye Name: 2-[4-[4-(2-isopropoxyphenyl)piperazin-1-yl]butyl]-4-(p-tolyl)phthalazin-1-one CAS Name: 4-(4-methylphenyl)-2-[4-[4-(2-propan-2-yloxyphenyl)-1-piperazinyl]butyl]-1-phthalazinone IUPAC Name: 4-(4-methylphenyl)-2-[4-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]butyl]phthalazin-1-one Traditional Name: 2-[4-[4-(2-isopropoxyphenyl)piperazino]butyl]-4-(p-tolyl)phthalazin-1-one Formula: C32H38N4O2 MolecularWeight: 510.66972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCCCN4CCN(CC4)C5=CC=CC=C5OC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCCCN4CCN(CC4)C5=CC=CC=C5OC(C)C

InChI

InChI=1S/C32H38N4O2/c1-24(2)38-30-13-7-6-12-29(30)35-22-20-34(21-23-35)18-8-9-19-36-32(37)28-11-5-4-10-27(28)31(33-36)26-16-14-25(3)15-17-26/h4-7,10-17,24H,8-9,18-23H2,1-3H3