(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 1-(phenylsulfonyl)cyclopentane-1-carboxylate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 1-(phenylsulfonyl)cyclopentane-1-carboxylate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 1-(benzenesulfonyl)cyclopentanecarboxylate CAS Name: 1-(benzenesulfonyl)-1-cyclopentanecarboxylic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 1-(benzenesulfonyl)cyclopentane-1-carboxylate Traditional Name: 1-besylcyclopentanecarboxylic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C23H22O7S MolecularWeight: 442.48158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3(CCCC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3(CCCC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H22O7S/c1-28-17-9-10-19-16(13-21(24)30-20(19)14-17)15-29-22(25)23(11-5-6-12-23)31(26,27)18-7-3-2-4-8-18/h2-4,7-10,13-14H,5-6,11-12,15H2,1H3