(phenylmethyl) (3S)-3-cyclohexyl-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]propanoate

Systemtic Name: (phenylmethyl) (3S)-3-cyclohexyl-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]propanoate Openeye Name: benzyl (3S)-3-cyclohexyl-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]propanoate CAS Name: (3S)-3-cyclohexyl-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-3-cyclohexyl-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]propanoate Traditional Name: (3S)-3-cyclohexyl-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]propionic acid benzyl ester Formula: C21H30O4 MolecularWeight: 346.4605

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)C(CC(=O)OCC2=CC=CC=C2)C3CCCCC3)C

Isomeric SMILES

CC1(OC[C@@H](O1)[C@@H](CC(=O)OCC2=CC=CC=C2)C3CCCCC3)C

InChI

InChI=1S/C21H30O4/c1-21(2)24-15-19(25-21)18(17-11-7-4-8-12-17)13-20(22)23-14-16-9-5-3-6-10-16/h3,5-6,9-10,17-19H,4,7-8,11-15H2,1-2H3/t18-,19+/m0/s1