(3S,6R)-6-oxidanyl-3-prop-1-en-2-yl-heptanoate

Systemtic Name: (3S,6R)-6-oxidanyl-3-prop-1-en-2-yl-heptanoate Openeye Name: (3S,6R)-6-hydroxy-3-isopropenyl-heptanoate CAS Name: (3S,6R)-6-hydroxy-3-(1-methylethenyl)heptanoate IUPAC Name: (3S,6R)-6-hydroxy-3-prop-1-en-2-ylheptanoate Traditional Name: (3S)-3-[(3R)-3-hydroxybutyl]-4-methyl-pent-4-enoate Formula: C10H17O3- MolecularWeight: 185.24018

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(CC(=O)[O-])C(=C)C)O

Isomeric SMILES

C[C@H](CC[C@@H](CC(=O)[O-])C(=C)C)O

InChI

InChI=1S/C10H18O3/c1-7(2)9(6-10(12)13)5-4-8(3)11/h8-9,11H,1,4-6H2,2-3H3,(H,12,13)/p-1/t8-,9+/m1/s1