[2-[(E)-but-2-enyl]-3-oxidanylidene-1,2-dihydroinden-5-yl] methanesulfonate

Systemtic Name: [2-[(E)-but-2-enyl]-3-oxidanylidene-1,2-dihydroinden-5-yl] methanesulfonate Openeye Name: [2-[(E)-but-2-enyl]-3-oxo-indan-5-yl] methanesulfonate CAS Name: methanesulfonic acid [2-[(E)-but-2-enyl]-3-oxo-1,2-dihydroinden-5-yl] ester IUPAC Name: [2-[(E)-but-2-enyl]-3-oxo-1,2-dihydroinden-5-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-[(E)-but-2-enyl]-3-keto-indan-5-yl] ester Formula: C14H16O4S MolecularWeight: 280.33944

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCC1CC2=C(C1=O)C=C(C=C2)OS(=O)(=O)C

Isomeric SMILES

C/C=C/CC1CC2=C(C1=O)C=C(C=C2)OS(=O)(=O)C

InChI

InChI=1S/C14H16O4S/c1-3-4-5-11-8-10-6-7-12(18-19(2,16)17)9-13(10)14(11)15/h3-4,6-7,9,11H,5,8H2,1-2H3/b4-3+