4-(3-cycloheptyl-5-ethoxy-2-oxidanylidene-benzimidazol-1-yl)sulfonyl-3-methoxy-benzoic acid

Systemtic Name: 4-(3-cycloheptyl-5-ethoxy-2-oxidanylidene-benzimidazol-1-yl)sulfonyl-3-methoxy-benzoic acid Openeye Name: 4-(3-cycloheptyl-5-ethoxy-2-oxo-benzimidazol-1-yl)sulfonyl-3-methoxy-benzoic acid CAS Name: 4-[(3-cycloheptyl-5-ethoxy-2-oxo-1-benzimidazolyl)sulfonyl]-3-methoxybenzoic acid IUPAC Name: 4-(3-cycloheptyl-5-ethoxy-2-oxobenzimidazol-1-yl)sulfonyl-3-methoxybenzoic acid Traditional Name: 4-(3-cycloheptyl-5-ethoxy-2-keto-benzimidazol-1-yl)sulfonyl-3-methoxy-benzoic acid Formula: C24H28N2O7S MolecularWeight: 488.55332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=O)N2C3CCCCCC3)S(=O)(=O)C4=C(C=C(C=C4)C(=O)O)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=O)N2C3CCCCCC3)S(=O)(=O)C4=C(C=C(C=C4)C(=O)O)OC

InChI

InChI=1S/C24H28N2O7S/c1-3-33-18-11-12-19-20(15-18)25(17-8-6-4-5-7-9-17)24(29)26(19)34(30,31)22-13-10-16(23(27)28)14-21(22)32-2/h10-15,17H,3-9H2,1-2H3,(H,27,28)