2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-[4-(3-methylphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-[4-(3-methylphenyl)piperazin-1-yl]ethanone Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-[4-(m-tolyl)piperazin-1-yl]ethanone CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-[4-(3-methylphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-[4-(3-methylphenyl)piperazin-1-yl]ethanone Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-[4-(m-tolyl)piperazino]ethanone Formula: C22H27N3O MolecularWeight: 349.46928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H27N3O/c1-18-5-4-8-21(15-18)24-11-13-25(14-12-24)22(26)17-23-10-9-19-6-2-3-7-20(19)16-23/h2-8,15H,9-14,16-17H2,1H3