2-[1-(2-heptyl-1,3-dioxolan-2-yl)cyclopropyl]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[1-(2-heptyl-1,3-dioxolan-2-yl)cyclopropyl]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[1-(2-heptyl-1,3-dioxolan-2-yl)cyclopropyl]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[1-(2-heptyl-1,3-dioxolan-2-yl)cyclopropyl]ethyl ester IUPAC Name: 2-[1-(2-heptyl-1,3-dioxolan-2-yl)cyclopropyl]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[1-(2-heptyl-1,3-dioxolan-2-yl)cyclopropyl]ethyl ester Formula: C22H34O5S MolecularWeight: 410.56736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(OCCO1)C2(CC2)CCOS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCCC1(OCCO1)C2(CC2)CCOS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H34O5S/c1-3-4-5-6-7-12-22(25-17-18-26-22)21(13-14-21)15-16-27-28(23,24)20-10-8-19(2)9-11-20/h8-11H,3-7,12-18H2,1-2H3