1-phenyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-1,4-dihydroisoquinolin-3-one

Systemtic Name: 1-phenyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-1,4-dihydroisoquinolin-3-one Openeye Name: 1-phenyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-1,4-dihydroisoquinolin-3-one CAS Name: 1-phenyl-2-[3-(4-phenyl-1-piperazinyl)propyl]-1,4-dihydroisoquinolin-3-one IUPAC Name: 1-phenyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-1,4-dihydroisoquinolin-3-one Traditional Name: 1-phenyl-2-[3-(4-phenylpiperazino)propyl]-1,4-dihydroisoquinolin-3-one Formula: C28H31N3O MolecularWeight: 425.56524

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN2C(C3=CC=CC=C3CC2=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCN2C(C3=CC=CC=C3CC2=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H31N3O/c32-27-22-24-12-7-8-15-26(24)28(23-10-3-1-4-11-23)31(27)17-9-16-29-18-20-30(21-19-29)25-13-5-2-6-14-25/h1-8,10-15,28H,9,16-22H2