2-[1,3-bis(oxidanylidene)inden-2-yl]ethyl 2,5-diethylbenzenesulfonate

Systemtic Name: 2-[1,3-bis(oxidanylidene)inden-2-yl]ethyl 2,5-diethylbenzenesulfonate Openeye Name: 2-(1,3-dioxoindan-2-yl)ethyl 2,5-diethylbenzenesulfonate CAS Name: 2,5-diethylbenzenesulfonic acid 2-(1,3-dioxo-2-indenyl)ethyl ester IUPAC Name: 2-(1,3-dioxoinden-2-yl)ethyl 2,5-diethylbenzenesulfonate Traditional Name: 2,5-diethylbenzenesulfonic acid 2-(1,3-diketoindan-2-yl)ethyl ester Formula: C21H22O5S MolecularWeight: 386.46138

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)CC)S(=O)(=O)OCCC2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCC1=CC(=C(C=C1)CC)S(=O)(=O)OCCC2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H22O5S/c1-3-14-9-10-15(4-2)19(13-14)27(24,25)26-12-11-18-20(22)16-7-5-6-8-17(16)21(18)23/h5-10,13,18H,3-4,11-12H2,1-2H3