methyl (E,4S,5R,6S)-4-acetyloxy-5-methyl-6-phenylmethoxy-hept-2-enoate

Systemtic Name: methyl (E,4S,5R,6S)-4-acetyloxy-5-methyl-6-phenylmethoxy-hept-2-enoate Openeye Name: methyl (E,4S,5R,6S)-4-acetoxy-6-benzyloxy-5-methyl-hept-2-enoate CAS Name: (E,4S,5R,6S)-4-acetyloxy-5-methyl-6-phenylmethoxy-2-heptenoic acid methyl ester IUPAC Name: methyl (E,4S,5R,6S)-4-acetyloxy-5-methyl-6-phenylmethoxyhept-2-enoate Traditional Name: (E,4S,5R,6S)-4-acetoxy-6-benzoxy-5-methyl-hept-2-enoic acid methyl ester Formula: C18H24O5 MolecularWeight: 320.38016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)OCC1=CC=CC=C1)C(C=CC(=O)OC)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C18H24O5/c1-13(14(2)22-12-16-8-6-5-7-9-16)17(23-15(3)19)10-11-18(20)21-4/h5-11,13-14,17H,12H2,1-4H3/b11-10+/t13-,14+,17+/m1/s1