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

Systemtic Name: 2-cyclopentyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(2-methylphenyl)carbonylpiperazin-1-yl]ethanone Openeye Name: 2-cyclopentyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(2-methylbenzoyl)piperazin-1-yl]ethanone CAS Name: 2-cyclopentyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 2-cyclopentyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(2-methylbenzoyl)piperazin-1-yl]ethanone Traditional Name: 2-cyclopentyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-o-toluoylpiperazino)ethanone Formula: C28H35N3O2 MolecularWeight: 445.5964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C(C3CCCC3)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C(C3CCCC3)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C28H35N3O2/c1-21-8-2-7-13-25(21)27(32)30-18-16-29(17-19-30)26(23-10-4-5-11-23)28(33)31-15-14-22-9-3-6-12-24(22)20-31/h2-3,6-9,12-13,23,26H,4-5,10-11,14-20H2,1H3