[7-(ethoxycarbonylamino)-2-oxidanylidene-chromen-4-yl]methyl 1-(2-fluorophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: [7-(ethoxycarbonylamino)-2-oxidanylidene-chromen-4-yl]methyl 1-(2-fluorophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: [7-(ethoxycarbonylamino)-2-oxo-chromen-4-yl]methyl 1-(2-fluorophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxylic acid [7-(ethoxycarbonylamino)-2-oxo-1-benzopyran-4-yl]methyl ester IUPAC Name: [7-(ethoxycarbonylamino)-2-oxochromen-4-yl]methyl 1-(2-fluorophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-fluorophenyl)sulfonylisonipecotic acid [7-(carbethoxyamino)-2-keto-chromen-4-yl]methyl ester Formula: C25H25FN2O8S MolecularWeight: 532.538003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C25H25FN2O8S/c1-2-34-25(31)27-18-7-8-19-17(13-23(29)36-21(19)14-18)15-35-24(30)16-9-11-28(12-10-16)37(32,33)22-6-4-3-5-20(22)26/h3-8,13-14,16H,2,9-12,15H2,1H3,(H,27,31)