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

Systemtic Name: 4-[[furan-2-ylmethyl-(2-methyl-5-nitro-phenyl)sulfonyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[2-furylmethyl-(2-methyl-5-nitro-phenyl)sulfonyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[2-furanylmethyl-(2-methyl-5-nitrophenyl)sulfonylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[furan-2-ylmethyl-(2-methyl-5-nitrophenyl)sulfonylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[2-furfuryl-(2-methyl-5-nitro-phenyl)sulfonyl-amino]methyl]-N-methyl-benzamide Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NC)CC3=CC=CO3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NC)CC3=CC=CO3

InChI

InChI=1S/C21H21N3O6S/c1-15-5-10-18(24(26)27)12-20(15)31(28,29)23(14-19-4-3-11-30-19)13-16-6-8-17(9-7-16)21(25)22-2/h3-12H,13-14H2,1-2H3,(H,22,25)