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

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(2-nitrophenyl)piperazin-1-yl]ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(2-nitrophenyl)piperazin-1-yl]ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(2-nitrophenyl)-1-piperazinyl]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(2-nitrophenyl)piperazin-1-yl]ethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[4-(2-nitrophenyl)piperazino]ethanone Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CN3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CN3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O3/c26-21(24-10-9-17-5-1-2-6-18(17)15-24)16-22-11-13-23(14-12-22)19-7-3-4-8-20(19)25(27)28/h1-8H,9-16H2