1-[6-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinolin-1-yl]ethanone

Systemtic Name: 1-[6-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinolin-1-yl]ethanone Openeye Name: 1-[6-(4-benzylpiperazin-1-yl)sulfonyl-3,4-dihydro-2H-quinolin-1-yl]ethanone CAS Name: 1-[6-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-3,4-dihydro-2H-quinolin-1-yl]ethanone IUPAC Name: 1-[6-(4-benzylpiperazin-1-yl)sulfonyl-3,4-dihydro-2H-quinolin-1-yl]ethanone Traditional Name: 1-[6-(4-benzylpiperazino)sulfonyl-3,4-dihydro-2H-quinolin-1-yl]ethanone Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O3S/c1-18(26)25-11-5-8-20-16-21(9-10-22(20)25)29(27,28)24-14-12-23(13-15-24)17-19-6-3-2-4-7-19/h2-4,6-7,9-10,16H,5,8,11-15,17H2,1H3