4-(1H-indol-3-yl)-1-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]butan-1-one

Systemtic Name: 4-(1H-indol-3-yl)-1-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]butan-1-one Openeye Name: 4-(1H-indol-3-yl)-1-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]butan-1-one CAS Name: 4-(1H-indol-3-yl)-1-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]-1-butanone IUPAC Name: 4-(1H-indol-3-yl)-1-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]butan-1-one Traditional Name: 4-(1H-indol-3-yl)-1-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]butan-1-one Formula: C23H26N4O6S MolecularWeight: 486.54074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCC3=CNC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCC3=CNC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C23H26N4O6S/c1-33-22-10-9-18(15-21(22)27(29)30)34(31,32)26-13-11-25(12-14-26)23(28)8-4-5-17-16-24-20-7-3-2-6-19(17)20/h2-3,6-7,9-10,15-16,24H,4-5,8,11-14H2,1H3