[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-3-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-3-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: (2-benzoyl-3,4-dihydro-1H-isoquinolin-3-yl)-(4-phenylpiperazin-1-yl)methanone CAS Name: (2-benzoyl-3,4-dihydro-1H-isoquinolin-3-yl)-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (2-benzoyl-3,4-dihydro-1H-isoquinolin-3-yl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: (2-benzoyl-3,4-dihydro-1H-isoquinolin-3-yl)-(4-phenylpiperazino)methanone Formula: C27H27N3O2 MolecularWeight: 425.52218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3CC4=CC=CC=C4CN3C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3CC4=CC=CC=C4CN3C(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H27N3O2/c31-26(21-9-3-1-4-10-21)30-20-23-12-8-7-11-22(23)19-25(30)27(32)29-17-15-28(16-18-29)24-13-5-2-6-14-24/h1-14,25H,15-20H2