[2-[(E)-1-phenylprop-1-en-2-yl]thiolan-3-yl]methyl benzoate

Systemtic Name: [2-[(E)-1-phenylprop-1-en-2-yl]thiolan-3-yl]methyl benzoate Openeye Name: [2-[(E)-1-methyl-2-phenyl-vinyl]tetrahydrothiophen-3-yl]methyl benzoate CAS Name: benzoic acid [2-[(E)-1-phenylprop-1-en-2-yl]-3-thiolanyl]methyl ester IUPAC Name: [2-[(E)-1-phenylprop-1-en-2-yl]thiolan-3-yl]methyl benzoate Traditional Name: benzoic acid [2-[(E)-1-methyl-2-phenyl-vinyl]tetrahydrothiophen-3-yl]methyl ester Formula: C21H22O2S MolecularWeight: 338.46318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C2C(CCS2)COC(=O)C3=CC=CC=C3

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/C2C(CCS2)COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22O2S/c1-16(14-17-8-4-2-5-9-17)20-19(12-13-24-20)15-23-21(22)18-10-6-3-7-11-18/h2-11,14,19-20H,12-13,15H2,1H3/b16-14+