1-(4-cyclobutylpiperazin-1-yl)-2-(6-ethanoyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 1-(4-cyclobutylpiperazin-1-yl)-2-(6-ethanoyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(6-acetyl-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-cyclobutylpiperazin-1-yl)ethanone CAS Name: 2-(6-acetyl-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-cyclobutyl-1-piperazinyl)ethanone IUPAC Name: 2-(6-acetyl-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-cyclobutylpiperazin-1-yl)ethanone Traditional Name: 2-(6-acetyl-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-cyclobutylpiperazino)ethanone Formula: C21H29N3O2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(CN(CC2)CC(=O)N3CCN(CC3)C4CCC4)C=C1

Isomeric SMILES

CC(=O)C1=CC2=C(CN(CC2)CC(=O)N3CCN(CC3)C4CCC4)C=C1

InChI

InChI=1S/C21H29N3O2/c1-16(25)17-5-6-19-14-22(8-7-18(19)13-17)15-21(26)24-11-9-23(10-12-24)20-3-2-4-20/h5-6,13,20H,2-4,7-12,14-15H2,1H3