(7-methyl-2-oxidanylidene-chromen-4-yl)methyl 1-(4-chlorophenyl)sulfonylcyclobutane-1-carboxylate

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 1-(4-chlorophenyl)sulfonylcyclobutane-1-carboxylate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 1-(4-chlorophenyl)sulfonylcyclobutanecarboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-1-cyclobutanecarboxylic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 1-(4-chlorophenyl)sulfonylcyclobutane-1-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonylcyclobutanecarboxylic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C22H19ClO6S MolecularWeight: 446.90066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3(CCC3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3(CCC3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H19ClO6S/c1-14-3-8-18-15(12-20(24)29-19(18)11-14)13-28-21(25)22(9-2-10-22)30(26,27)17-6-4-16(23)5-7-17/h3-8,11-12H,2,9-10,13H2,1H3