methyl 6-[4-(4-morpholin-4-ylcarbonyl-2-nitro-phenyl)piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinoline-1-carboxylate

Systemtic Name: methyl 6-[4-(4-morpholin-4-ylcarbonyl-2-nitro-phenyl)piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinoline-1-carboxylate Openeye Name: methyl 6-[4-[4-(morpholine-4-carbonyl)-2-nitro-phenyl]piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinoline-1-carboxylate CAS Name: 6-[[4-[4-[4-morpholinyl(oxo)methyl]-2-nitrophenyl]-1-piperazinyl]sulfonyl]-3,4-dihydro-2H-quinoline-1-carboxylic acid methyl ester IUPAC Name: methyl 6-[4-[4-(morpholine-4-carbonyl)-2-nitrophenyl]piperazin-1-yl]sulfonyl-3,4-dihydro-2H-quinoline-1-carboxylate Traditional Name: 6-[4-[4-(morpholine-4-carbonyl)-2-nitro-phenyl]piperazino]sulfonyl-3,4-dihydro-2H-quinoline-1-carboxylic acid methyl ester Formula: C26H31N5O8S MolecularWeight: 573.61804

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=C(C=C(C=C4)C(=O)N5CCOCC5)[N+](=O)[O-]

Isomeric SMILES

COC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=C(C=C(C=C4)C(=O)N5CCOCC5)[N+](=O)[O-]

InChI

InChI=1S/C26H31N5O8S/c1-38-26(33)30-8-2-3-19-17-21(5-7-22(19)30)40(36,37)29-11-9-27(10-12-29)23-6-4-20(18-24(23)31(34)35)25(32)28-13-15-39-16-14-28/h4-7,17-18H,2-3,8-16H2,1H3