3,4-dihydro-1H-isoquinolin-2-yl-[4-[4-(3-methoxyphenyl)piperazin-1-yl]phthalazin-1-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[4-(3-methoxyphenyl)piperazin-1-yl]phthalazin-1-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[4-(3-methoxyphenyl)piperazin-1-yl]phthalazin-1-yl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[4-(3-methoxyphenyl)-1-piperazinyl]-1-phthalazinyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[4-(3-methoxyphenyl)piperazin-1-yl]phthalazin-1-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[4-(3-methoxyphenyl)piperazino]phthalazin-1-yl]methanone Formula: C29H29N5O2 MolecularWeight: 479.57286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)N5CCC6=CC=CC=C6C5

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)N5CCC6=CC=CC=C6C5

InChI

InChI=1S/C29H29N5O2/c1-36-24-10-6-9-23(19-24)32-15-17-33(18-16-32)28-26-12-5-4-11-25(26)27(30-31-28)29(35)34-14-13-21-7-2-3-8-22(21)20-34/h2-12,19H,13-18,20H2,1H3