4-[[(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonyl-(furan-2-ylmethyl)amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonyl-(furan-2-ylmethyl)amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[(3-chloro-4-methyl-5-nitro-phenyl)sulfonyl-(2-furylmethyl)amino]methyl]-N-methyl-benzamide CAS Name: 4-[[(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-(2-furanylmethyl)amino]methyl]-N-methylbenzamide IUPAC Name: 4-[[(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-(furan-2-ylmethyl)amino]methyl]-N-methylbenzamide Traditional Name: 4-[[(3-chloro-4-methyl-5-nitro-phenyl)sulfonyl-(2-furfuryl)amino]methyl]-N-methyl-benzamide Formula: C21H20ClN3O6S MolecularWeight: 477.918

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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)Cl

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)Cl

InChI

InChI=1S/C21H20ClN3O6S/c1-14-19(22)10-18(11-20(14)25(27)28)32(29,30)24(13-17-4-3-9-31-17)12-15-5-7-16(8-6-15)21(26)23-2/h3-11H,12-13H2,1-2H3,(H,23,26)