methyl (3R,5S,6R)-6-methyl-5-oxidanyl-7-phenylmethoxy-3-prop-2-enyl-heptanoate

Systemtic Name: methyl (3R,5S,6R)-6-methyl-5-oxidanyl-7-phenylmethoxy-3-prop-2-enyl-heptanoate Openeye Name: methyl (3R,5S,6R)-3-allyl-7-benzyloxy-5-hydroxy-6-methyl-heptanoate CAS Name: (3R,5S,6R)-5-hydroxy-6-methyl-7-phenylmethoxy-3-prop-2-enylheptanoic acid methyl ester IUPAC Name: methyl (3R,5S,6R)-5-hydroxy-6-methyl-7-phenylmethoxy-3-prop-2-enylheptanoate Traditional Name: (3R)-3-[(2S,3R)-4-benzoxy-2-hydroxy-3-methyl-butyl]hex-5-enoic acid methyl ester Formula: C19H28O4 MolecularWeight: 320.42322

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Descriptors Computed from Structure

Canonical SMILES:

CC(COCC1=CC=CC=C1)C(CC(CC=C)CC(=O)OC)O

Isomeric SMILES

C[C@H](COCC1=CC=CC=C1)[C@H](C[C@@H](CC=C)CC(=O)OC)O

InChI

InChI=1S/C19H28O4/c1-4-8-17(12-19(21)22-3)11-18(20)15(2)13-23-14-16-9-6-5-7-10-16/h4-7,9-10,15,17-18,20H,1,8,11-14H2,2-3H3/t15-,17-,18+/m1/s1