[1-(2-bromanyl-4-methoxy-phenyl)sulfonyl-5-nitro-indol-3-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [1-(2-bromanyl-4-methoxy-phenyl)sulfonyl-5-nitro-indol-3-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [1-(2-bromo-4-methoxy-phenyl)sulfonyl-5-nitro-indol-3-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: [1-(2-bromo-4-methoxyphenyl)sulfonyl-5-nitro-3-indolyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [1-(2-bromo-4-methoxyphenyl)sulfonyl-5-nitroindol-3-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [1-(2-bromo-4-methoxy-phenyl)sulfonyl-5-nitro-indol-3-yl]-(4-methylpiperazino)methanone Formula: C21H21BrN4O6S MolecularWeight: 537.38364

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CN(C3=C2C=C(C=C3)[N+](=O)[O-])S(=O)(=O)C4=C(C=C(C=C4)OC)Br

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CN(C3=C2C=C(C=C3)[N+](=O)[O-])S(=O)(=O)C4=C(C=C(C=C4)OC)Br

InChI

InChI=1S/C21H21BrN4O6S/c1-23-7-9-24(10-8-23)21(27)17-13-25(19-5-3-14(26(28)29)11-16(17)19)33(30,31)20-6-4-15(32-2)12-18(20)22/h3-6,11-13H,7-10H2,1-2H3