N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-3,5-dinitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-3,5-dinitro-4-piperidin-1-yl-benzamide Openeye Name: N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-3,5-dinitro-4-(1-piperidyl)benzamide CAS Name: N-[4-[(6-methoxy-3-pyridazinyl)sulfamoyl]phenyl]-3,5-dinitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-3,5-dinitro-4-piperidin-1-ylbenzamide Traditional Name: N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]-3,5-dinitro-4-piperidino-benzamide Formula: C23H23N7O8S MolecularWeight: 557.53582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

COC1=NN=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C(=C3)[N+](=O)[O-])N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H23N7O8S/c1-38-21-10-9-20(25-26-21)27-39(36,37)17-7-5-16(6-8-17)24-23(31)15-13-18(29(32)33)22(19(14-15)30(34)35)28-11-3-2-4-12-28/h5-10,13-14H,2-4,11-12H2,1H3,(H,24,31)(H,25,27)