N-(1-ethoxycarbonylpiperidin-4-yl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzenecarboximidate

Systemtic Name: N-(1-ethoxycarbonylpiperidin-4-yl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzenecarboximidate Openeye Name: N-(1-ethoxycarbonyl-4-piperidyl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzenecarboximidate CAS Name: N-(1-ethoxycarbonyl-4-piperidinyl)-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzenecarboximidate IUPAC Name: N-(1-ethoxycarbonylpiperidin-4-yl)-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzenecarboximidate Traditional Name: N-(1-carbethoxy-4-piperidyl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzenecarboximidate Formula: C22H25N4O7S- MolecularWeight: 489.5215

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N=C(C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-])[O-]

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N=C(C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-])[O-]

InChI

InChI=1S/C22H26N4O7S/c1-3-33-22(28)25-12-10-17(11-13-25)23-21(27)16-5-7-18(8-6-16)24-34(31,32)19-9-4-15(2)20(14-19)26(29)30/h4-9,14,17,24H,3,10-13H2,1-2H3,(H,23,27)/p-1