5-ethoxy-1-(2-methoxy-4-nitro-phenyl)sulfonyl-3-(2,4,4-trimethylpentan-2-yl)benzimidazol-2-one

Systemtic Name: 5-ethoxy-1-(2-methoxy-4-nitro-phenyl)sulfonyl-3-(2,4,4-trimethylpentan-2-yl)benzimidazol-2-one Openeye Name: 5-ethoxy-1-(2-methoxy-4-nitro-phenyl)sulfonyl-3-(1,1,3,3-tetramethylbutyl)benzimidazol-2-one CAS Name: 5-ethoxy-1-(2-methoxy-4-nitrophenyl)sulfonyl-3-(2,4,4-trimethylpentan-2-yl)-2-benzimidazolone IUPAC Name: 5-ethoxy-1-(2-methoxy-4-nitrophenyl)sulfonyl-3-(2,4,4-trimethylpentan-2-yl)benzimidazol-2-one Traditional Name: 5-ethoxy-1-(2-methoxy-4-nitro-phenyl)sulfonyl-3-(1,1,3,3-tetramethylbutyl)benzimidazol-2-one Formula: C24H31N3O7S MolecularWeight: 505.58384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=O)N2C(C)(C)CC(C)(C)C)S(=O)(=O)C3=C(C=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=O)N2C(C)(C)CC(C)(C)C)S(=O)(=O)C3=C(C=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C24H31N3O7S/c1-8-34-17-10-11-18-19(14-17)25(24(5,6)15-23(2,3)4)22(28)26(18)35(31,32)21-12-9-16(27(29)30)13-20(21)33-7/h9-14H,8,15H2,1-7H3