(E)-3-methyl-5-(2-methyl-3-oxidanyl-cyclohexen-1-yl)pent-2-en-4-ynoic acid

Systemtic Name: (E)-3-methyl-5-(2-methyl-3-oxidanyl-cyclohexen-1-yl)pent-2-en-4-ynoic acid Openeye Name: (E)-5-(3-hydroxy-2-methyl-cyclohexen-1-yl)-3-methyl-pent-2-en-4-ynoic acid CAS Name: (E)-5-(3-hydroxy-2-methyl-1-cyclohexenyl)-3-methylpent-2-en-4-ynoic acid IUPAC Name: (E)-5-(3-hydroxy-2-methylcyclohexen-1-yl)-3-methylpent-2-en-4-ynoic acid Traditional Name: (E)-5-(3-hydroxy-2-methyl-cyclohexen-1-yl)-3-methyl-pent-2-en-4-ynoic acid Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CCCC1O)C#CC(=CC(=O)O)C

Isomeric SMILES

CC1=C(CCCC1O)C#C/C(=C/C(=O)O)/C

InChI

InChI=1S/C13H16O3/c1-9(8-13(15)16)6-7-11-4-3-5-12(14)10(11)2/h8,12,14H,3-5H2,1-2H3,(H,15,16)/b9-8+