N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[3-[4-(4-methoxyphenyl)piperazino]propyl]-3-phenyl-phthalazine-1-carboxamide Formula: C29H31N5O3 MolecularWeight: 497.58814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCCNC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCCNC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C29H31N5O3/c1-37-24-14-12-22(13-15-24)33-20-18-32(19-21-33)17-7-16-30-28(35)27-25-10-5-6-11-26(25)29(36)34(31-27)23-8-3-2-4-9-23/h2-6,8-15H,7,16-21H2,1H3,(H,30,35)