2-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]-4-phenyl-phthalazin-1-one

Systemtic Name: 2-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]-4-phenyl-phthalazin-1-one Openeye Name: 2-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]-4-phenyl-phthalazin-1-one CAS Name: 2-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]-4-phenyl-1-phthalazinone IUPAC Name: 2-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]-4-phenylphthalazin-1-one Traditional Name: 2-[3-keto-3-(4-phenylpiperazino)propyl]-4-phenyl-phthalazin-1-one Formula: C27H26N4O2 MolecularWeight: 438.52094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CCN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CCN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O2/c32-25(30-19-17-29(18-20-30)22-11-5-2-6-12-22)15-16-31-27(33)24-14-8-7-13-23(24)26(28-31)21-9-3-1-4-10-21/h1-14H,15-20H2