[(1R,2S)-2-methyl-1-(phenylmethyl)cyclopropyl] 4-methylbenzenesulfonate

Systemtic Name: [(1R,2S)-2-methyl-1-(phenylmethyl)cyclopropyl] 4-methylbenzenesulfonate Openeye Name: [(1R,2S)-1-benzyl-2-methyl-cyclopropyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(1R,2S)-2-methyl-1-(phenylmethyl)cyclopropyl] ester IUPAC Name: [(1R,2S)-1-benzyl-2-methylcyclopropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1R,2S)-1-benzyl-2-methyl-cyclopropyl] ester Formula: C18H20O3S MolecularWeight: 316.4146

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1(CC2=CC=CC=C2)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

C[C@H]1C[C@]1(CC2=CC=CC=C2)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C18H20O3S/c1-14-8-10-17(11-9-14)22(19,20)21-18(12-15(18)2)13-16-6-4-3-5-7-16/h3-11,15H,12-13H2,1-2H3/t15-,18+/m0/s1