methyl (2E)-2-ethylidene-4-methyl-3-oxidanyl-pentanoate

Systemtic Name: methyl (2E)-2-ethylidene-4-methyl-3-oxidanyl-pentanoate Openeye Name: methyl (2E)-2-ethylidene-3-hydroxy-4-methyl-pentanoate CAS Name: (2E)-2-ethylidene-3-hydroxy-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2E)-2-ethylidene-3-hydroxy-4-methylpentanoate Traditional Name: (E)-2-(1-hydroxy-2-methyl-propyl)but-2-enoic acid methyl ester Formula: C9H16O3 MolecularWeight: 172.22154

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C(C(C)C)O)C(=O)OC

Isomeric SMILES

C/C=C(\C(C(C)C)O)/C(=O)OC

InChI

InChI=1S/C9H16O3/c1-5-7(9(11)12-4)8(10)6(2)3/h5-6,8,10H,1-4H3/b7-5+