[1-[(E)-prop-1-enyl]cyclopropyl] 4-methylbenzenesulfonate

Systemtic Name: [1-[(E)-prop-1-enyl]cyclopropyl] 4-methylbenzenesulfonate Openeye Name: [1-[(E)-prop-1-enyl]cyclopropyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-[(E)-prop-1-enyl]cyclopropyl] ester IUPAC Name: [1-[(E)-prop-1-enyl]cyclopropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [1-[(E)-prop-1-enyl]cyclopropyl] ester Formula: C13H16O3S MolecularWeight: 252.32934

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1(CC1)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

C/C=C/C1(CC1)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C13H16O3S/c1-3-8-13(9-10-13)16-17(14,15)12-6-4-11(2)5-7-12/h3-8H,9-10H2,1-2H3/b8-3+