(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl 2,4-bis(oxidanyl)benzoate

Systemtic Name: (1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl 2,4-bis(oxidanyl)benzoate Openeye Name: (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl 2,4-dihydroxybenzoate CAS Name: 2,4-dihydroxybenzoic acid [1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]methyl ester IUPAC Name: (1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)methyl 2,4-dihydroxybenzoate Traditional Name: 2,4-dihydroxybenzoic acid (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl ester Formula: C21H23N3O7S MolecularWeight: 461.48822

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)C4=C(C=C(C=C4)O)O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)C4=C(C=C(C=C4)O)O

InChI

InChI=1S/C21H23N3O7S/c1-2-24-18-6-4-15(32(28,29)23-7-9-30-10-8-23)12-17(18)22-20(24)13-31-21(27)16-5-3-14(25)11-19(16)26/h3-6,11-12,25-26H,2,7-10,13H2,1H3