[(2S)-hept-6-en-2-yl] (3R,5S)-3-methoxy-4-oxidanylidene-5-phenylmethoxy-hept-6-enoate

Systemtic Name: [(2S)-hept-6-en-2-yl] (3R,5S)-3-methoxy-4-oxidanylidene-5-phenylmethoxy-hept-6-enoate Openeye Name: [(1S)-1-methylhex-5-enyl] (3R,5S)-5-benzyloxy-3-methoxy-4-oxo-hept-6-enoate CAS Name: (3R,5S)-3-methoxy-4-oxo-5-phenylmethoxy-6-heptenoic acid [(2S)-hept-6-en-2-yl] ester IUPAC Name: [(2S)-hept-6-en-2-yl] (3R,5S)-3-methoxy-4-oxo-5-phenylmethoxyhept-6-enoate Traditional Name: (3R,5S)-5-benzoxy-4-keto-3-methoxy-hept-6-enoic acid [(1S)-1-methylhex-5-enyl] ester Formula: C22H30O5 MolecularWeight: 374.4706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30O5/c1-5-7-9-12-17(3)27-21(23)15-20(25-4)22(24)19(6-2)26-16-18-13-10-8-11-14-18/h5-6,8,10-11,13-14,17,19-20H,1-2,7,9,12,15-16H2,3-4H3/t17-,19-,20+/m0/s1