methyl (1R,5R,6S)-4-methoxy-2,2-dimethyl-7-oxidanylidene-6-phenylsulfanyl-spiro[bicyclo[3.2.1]oct-3-ene-8,1'-cyclopropane]-5-carboxylate

Systemtic Name: methyl (1R,5R,6S)-4-methoxy-2,2-dimethyl-7-oxidanylidene-6-phenylsulfanyl-spiro[bicyclo[3.2.1]oct-3-ene-8,1'-cyclopropane]-5-carboxylate Openeye Name: methyl (1R,5R,6S)-4-methoxy-2,2-dimethyl-7-oxo-6-phenylsulfanyl-spiro[bicyclo[3.2.1]oct-3-ene-8,1'-cyclopropane]-5-carboxylate CAS Name: (1R,5R,6S)-4-methoxy-2,2-dimethyl-7-oxo-6-(phenylthio)-5-spiro[bicyclo[3.2.1]oct-3-ene-8,1'-cyclopropane]carboxylic acid methyl ester IUPAC Name: methyl (1R,5R,6S)-4-methoxy-2,2-dimethyl-7-oxo-6-phenylsulfanylspiro[bicyclo[3.2.1]oct-3-ene-8,1'-cyclopropane]-5-carboxylate Traditional Name: (1R,5R,6S)-7-keto-4-methoxy-2,2-dimethyl-6-(phenylthio)spiro[bicyclo[3.2.1]oct-3-ene-8,1'-cyclopropane]-5-carboxylic acid methyl ester Formula: C21H24O4S MolecularWeight: 372.47786

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C2(C(C(=O)C1C23CC3)SC4=CC=CC=C4)C(=O)OC)OC)C

Isomeric SMILES

CC1(C=C([C@@]2([C@@H](C(=O)[C@H]1C23CC3)SC4=CC=CC=C4)C(=O)OC)OC)C

InChI

InChI=1S/C21H24O4S/c1-19(2)12-14(24-3)21(18(23)25-4)17(26-13-8-6-5-7-9-13)15(22)16(19)20(21)10-11-20/h5-9,12,16-17H,10-11H2,1-4H3/t16-,17-,21-/m1/s1