ethyl 4-[[(1R)-1,7-dimethyl-3-oxidanylidene-1,2-dihydroinden-4-yl]oxysulfonyl]benzoate

Systemtic Name: ethyl 4-[[(1R)-1,7-dimethyl-3-oxidanylidene-1,2-dihydroinden-4-yl]oxysulfonyl]benzoate Openeye Name: ethyl 4-[(1R)-1,7-dimethyl-3-oxo-indan-4-yl]oxysulfonylbenzoate CAS Name: 4-[[(1R)-1,7-dimethyl-3-oxo-1,2-dihydroinden-4-yl]oxysulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(1R)-1,7-dimethyl-3-oxo-1,2-dihydroinden-4-yl]oxysulfonyl]benzoate Traditional Name: 4-[(1R)-3-keto-1,7-dimethyl-indan-4-yl]oxysulfonylbenzoic acid ethyl ester Formula: C20H20O6S MolecularWeight: 388.4342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=O)CC(C3=C(C=C2)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=O)C[C@H](C3=C(C=C2)C)C

InChI

InChI=1S/C20H20O6S/c1-4-25-20(22)14-6-8-15(9-7-14)27(23,24)26-17-10-5-12(2)18-13(3)11-16(21)19(17)18/h5-10,13H,4,11H2,1-3H3/t13-/m1/s1