tert-butyl (2R)-3-oxidanylidene-2-[(E)-4-(phenylsulfonyl)but-2-enyl]-1H-indene-2-carboxylate

Systemtic Name: tert-butyl (2R)-3-oxidanylidene-2-[(E)-4-(phenylsulfonyl)but-2-enyl]-1H-indene-2-carboxylate Openeye Name: tert-butyl (2R)-2-[(E)-4-(benzenesulfonyl)but-2-enyl]-1-oxo-indane-2-carboxylate CAS Name: (2R)-2-[(E)-4-(benzenesulfonyl)but-2-enyl]-3-oxo-1H-indene-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[(E)-4-(benzenesulfonyl)but-2-enyl]-3-oxo-1H-indene-2-carboxylate Traditional Name: (2R)-2-[(E)-4-besylbut-2-enyl]-1-keto-indane-2-carboxylic acid tert-butyl ester Formula: C24H26O5S MolecularWeight: 426.52524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(CC2=CC=CC=C2C1=O)CC=CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)[C@@]1(CC2=CC=CC=C2C1=O)C/C=C/CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H26O5S/c1-23(2,3)29-22(26)24(17-18-11-7-8-14-20(18)21(24)25)15-9-10-16-30(27,28)19-12-5-4-6-13-19/h4-14H,15-17H2,1-3H3/b10-9+/t24-/m1/s1