methyl 5-methoxy-3-(phenylsulfonyl)-1,2,6,6a-tetrahydropentalene-1-carboxylate

Systemtic Name: methyl 5-methoxy-3-(phenylsulfonyl)-1,2,6,6a-tetrahydropentalene-1-carboxylate Openeye Name: methyl 3-(benzenesulfonyl)-5-methoxy-1,2,6,6a-tetrahydropentalene-1-carboxylate CAS Name: 3-(benzenesulfonyl)-5-methoxy-1,2,6,6a-tetrahydropentalene-1-carboxylic acid methyl ester IUPAC Name: methyl 3-(benzenesulfonyl)-5-methoxy-1,2,6,6a-tetrahydropentalene-1-carboxylate Traditional Name: 3-besyl-5-methoxy-1,2,6,6a-tetrahydropentalene-1-carboxylic acid methyl ester Formula: C17H18O5S MolecularWeight: 334.38682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CC(C2C1)C(=O)OC)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(CC(C2C1)C(=O)OC)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H18O5S/c1-21-11-8-13-14(9-11)16(10-15(13)17(18)22-2)23(19,20)12-6-4-3-5-7-12/h3-7,9,13,15H,8,10H2,1-2H3