(phenylmethyl) 4-(3-cyclohexyl-5-ethoxy-2-oxidanylidene-benzimidazol-1-yl)sulfonyl-3-methoxy-benzoate

Systemtic Name: (phenylmethyl) 4-(3-cyclohexyl-5-ethoxy-2-oxidanylidene-benzimidazol-1-yl)sulfonyl-3-methoxy-benzoate Openeye Name: benzyl 4-(3-cyclohexyl-5-ethoxy-2-oxo-benzimidazol-1-yl)sulfonyl-3-methoxy-benzoate CAS Name: 4-[(3-cyclohexyl-5-ethoxy-2-oxo-1-benzimidazolyl)sulfonyl]-3-methoxybenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(3-cyclohexyl-5-ethoxy-2-oxobenzimidazol-1-yl)sulfonyl-3-methoxybenzoate Traditional Name: 4-(3-cyclohexyl-5-ethoxy-2-keto-benzimidazol-1-yl)sulfonyl-3-methoxy-benzoic acid benzyl ester Formula: C30H32N2O7S MolecularWeight: 564.64928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=O)N2C3CCCCC3)S(=O)(=O)C4=C(C=C(C=C4)C(=O)OCC5=CC=CC=C5)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=O)N2C3CCCCC3)S(=O)(=O)C4=C(C=C(C=C4)C(=O)OCC5=CC=CC=C5)OC

InChI

InChI=1S/C30H32N2O7S/c1-3-38-24-15-16-25-26(19-24)31(23-12-8-5-9-13-23)30(34)32(25)40(35,36)28-17-14-22(18-27(28)37-2)29(33)39-20-21-10-6-4-7-11-21/h4,6-7,10-11,14-19,23H,3,5,8-9,12-13,20H2,1-2H3