4-[[furan-2-ylmethyl-(2-methoxy-5-nitro-phenyl)sulfonyl-amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[furan-2-ylmethyl-(2-methoxy-5-nitro-phenyl)sulfonyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[2-furylmethyl-(2-methoxy-5-nitro-phenyl)sulfonyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[2-furanylmethyl-(2-methoxy-5-nitrophenyl)sulfonylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[furan-2-ylmethyl-(2-methoxy-5-nitrophenyl)sulfonylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[2-furfuryl-(2-methoxy-5-nitro-phenyl)sulfonyl-amino]methyl]-N-methyl-benzamide Formula: C21H21N3O7S MolecularWeight: 459.47234

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H21N3O7S/c1-22-21(25)16-7-5-15(6-8-16)13-23(14-18-4-3-11-31-18)32(28,29)20-12-17(24(26)27)9-10-19(20)30-2/h3-12H,13-14H2,1-2H3,(H,22,25)