1,3-bis[(4-methyl-3-nitro-phenyl)sulfonyl]-2H-benzimidazole

Systemtic Name: 1,3-bis[(4-methyl-3-nitro-phenyl)sulfonyl]-2H-benzimidazole Openeye Name: 1,3-bis[(4-methyl-3-nitro-phenyl)sulfonyl]-2H-benzimidazole CAS Name: 1,3-bis[(4-methyl-3-nitrophenyl)sulfonyl]-2H-benzimidazole IUPAC Name: 1,3-bis[(4-methyl-3-nitrophenyl)sulfonyl]-2H-benzimidazole Traditional Name: 1,3-bis[(4-methyl-3-nitro-phenyl)sulfonyl]-2H-benzimidazole Formula: C21H18N4O8S2 MolecularWeight: 518.51962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CN(C3=CC=CC=C32)S(=O)(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CN(C3=CC=CC=C32)S(=O)(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O8S2/c1-14-7-9-16(11-20(14)24(26)27)34(30,31)22-13-23(19-6-4-3-5-18(19)22)35(32,33)17-10-8-15(2)21(12-17)25(28)29/h3-12H,13H2,1-2H3