2-[4-[4-(diphenylmethyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-(4-methoxyphenyl)pyridazin-3-one

Systemtic Name: 2-[4-[4-(diphenylmethyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-(4-methoxyphenyl)pyridazin-3-one Openeye Name: 2-[4-(4-benzhydrylpiperazin-1-yl)-4-oxo-butyl]-6-(4-methoxyphenyl)pyridazin-3-one CAS Name: 2-[4-[4-(diphenylmethyl)-1-piperazinyl]-4-oxobutyl]-6-(4-methoxyphenyl)-3-pyridazinone IUPAC Name: 2-[4-(4-benzhydrylpiperazin-1-yl)-4-oxobutyl]-6-(4-methoxyphenyl)pyridazin-3-one Traditional Name: 2-[4-(4-benzhydrylpiperazino)-4-keto-butyl]-6-(4-methoxyphenyl)pyridazin-3-one Formula: C32H34N4O3 MolecularWeight: 522.63736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H34N4O3/c1-39-28-16-14-25(15-17-28)29-18-19-31(38)36(33-29)20-8-13-30(37)34-21-23-35(24-22-34)32(26-9-4-2-5-10-26)27-11-6-3-7-12-27/h2-7,9-12,14-19,32H,8,13,20-24H2,1H3