methyl 6-[4-(3-phenylquinoxalin-2-yl)piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinoline-1-carboxylate

Systemtic Name: methyl 6-[4-(3-phenylquinoxalin-2-yl)piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinoline-1-carboxylate Openeye Name: methyl 6-[4-(3-phenylquinoxalin-2-yl)piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinoline-1-carboxylate CAS Name: 6-[[4-(3-phenyl-2-quinoxalinyl)-1-piperazinyl]sulfonyl]-3,4-dihydro-2H-quinoline-1-carboxylic acid methyl ester IUPAC Name: methyl 6-[4-(3-phenylquinoxalin-2-yl)piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinoline-1-carboxylate Traditional Name: 6-[4-(3-phenylquinoxalin-2-yl)piperazino]sulfonyl-3,4-dihydro-2H-quinoline-1-carboxylic acid methyl ester Formula: C29H29N5O4S MolecularWeight: 543.63666

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=NC5=CC=CC=C5N=C4C6=CC=CC=C6

Isomeric SMILES

COC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=NC5=CC=CC=C5N=C4C6=CC=CC=C6

InChI

InChI=1S/C29H29N5O4S/c1-38-29(35)34-15-7-10-22-20-23(13-14-26(22)34)39(36,37)33-18-16-32(17-19-33)28-27(21-8-3-2-4-9-21)30-24-11-5-6-12-25(24)31-28/h2-6,8-9,11-14,20H,7,10,15-19H2,1H3