[(1S,2S)-2-[(E)-2-phenylethenyl]cyclohexyl] benzoate

Systemtic Name: [(1S,2S)-2-[(E)-2-phenylethenyl]cyclohexyl] benzoate Openeye Name: [(1S,2S)-2-[(E)-styryl]cyclohexyl] benzoate CAS Name: benzoic acid [(1S,2S)-2-[(E)-2-phenylethenyl]cyclohexyl] ester IUPAC Name: [(1S,2S)-2-[(E)-2-phenylethenyl]cyclohexyl] benzoate Traditional Name: benzoic acid [(1S,2S)-2-[(E)-styryl]cyclohexyl] ester Formula: C21H22O2 MolecularWeight: 306.39818

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C=CC2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC[C@@H]([C@@H](C1)/C=C/C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22O2/c22-21(19-12-5-2-6-13-19)23-20-14-8-7-11-18(20)16-15-17-9-3-1-4-10-17/h1-6,9-10,12-13,15-16,18,20H,7-8,11,14H2/b16-15+/t18-,20-/m0/s1