methyl 5-[(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxymethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxymethyl]furan-2-carboxylate Openeye Name: methyl 5-[(6-morpholinosulfonylbenzotriazol-1-yl)oxymethyl]furan-2-carboxylate CAS Name: 5-[[6-(4-morpholinylsulfonyl)-1-benzotriazolyl]oxymethyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxymethyl]furan-2-carboxylate Traditional Name: 5-[(6-morpholinosulfonylbenzotriazol-1-yl)oxymethyl]furan-2-carboxylic acid methyl ester Formula: C17H18N4O7S MolecularWeight: 422.41242

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CON2C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N=N2

Isomeric SMILES

COC(=O)C1=CC=C(O1)CON2C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N=N2

InChI

InChI=1S/C17H18N4O7S/c1-25-17(22)16-5-2-12(28-16)11-27-21-15-10-13(3-4-14(15)18-19-21)29(23,24)20-6-8-26-9-7-20/h2-5,10H,6-9,11H2,1H3