ethyl (E,4S,6S)-6-methyl-4-[(1R)-1-phenylmethoxypropyl]oct-2-enoate

Systemtic Name: ethyl (E,4S,6S)-6-methyl-4-[(1R)-1-phenylmethoxypropyl]oct-2-enoate Openeye Name: ethyl (E,4S,6S)-4-[(1R)-1-benzyloxypropyl]-6-methyl-oct-2-enoate CAS Name: (E,4S,6S)-6-methyl-4-[(1R)-1-phenylmethoxypropyl]-2-octenoic acid ethyl ester IUPAC Name: ethyl (E,4S,6S)-6-methyl-4-[(1R)-1-phenylmethoxypropyl]oct-2-enoate Traditional Name: (E,4S,6S)-4-[(1R)-1-benzoxypropyl]-6-methyl-oct-2-enoic acid ethyl ester Formula: C21H32O3 MolecularWeight: 332.47698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(C=CC(=O)OCC)C(CC)OCC1=CC=CC=C1

Isomeric SMILES

CC[C@H](C)C[C@@H](/C=C/C(=O)OCC)[C@@H](CC)OCC1=CC=CC=C1

InChI

InChI=1S/C21H32O3/c1-5-17(4)15-19(13-14-21(22)23-7-3)20(6-2)24-16-18-11-9-8-10-12-18/h8-14,17,19-20H,5-7,15-16H2,1-4H3/b14-13+/t17-,19+,20+/m0/s1