1-[[(4S,5S)-2,2-dimethyl-5-pent-3-ynyl-1,3-dioxolan-4-yl]methyl]cyclohexa-2,5-diene-1-carboxylic acid

Systemtic Name: 1-[[(4S,5S)-2,2-dimethyl-5-pent-3-ynyl-1,3-dioxolan-4-yl]methyl]cyclohexa-2,5-diene-1-carboxylic acid Openeye Name: 1-[[(4S,5S)-2,2-dimethyl-5-pent-3-ynyl-1,3-dioxolan-4-yl]methyl]cyclohexa-2,5-diene-1-carboxylic acid CAS Name: 1-[[(4S,5S)-2,2-dimethyl-5-pent-3-ynyl-1,3-dioxolan-4-yl]methyl]-1-cyclohexa-2,5-dienecarboxylic acid IUPAC Name: 1-[[(4S,5S)-2,2-dimethyl-5-pent-3-ynyl-1,3-dioxolan-4-yl]methyl]cyclohexa-2,5-diene-1-carboxylic acid Traditional Name: 1-[[(4S,5S)-2,2-dimethyl-5-pent-3-ynyl-1,3-dioxolan-4-yl]methyl]cyclohexa-2,5-diene-1-carboxylic acid Formula: C18H24O4 MolecularWeight: 304.38076

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCCC1C(OC(O1)(C)C)CC2(C=CCC=C2)C(=O)O

Isomeric SMILES

CC#CCC[C@H]1[C@@H](OC(O1)(C)C)CC2(C=CCC=C2)C(=O)O

InChI

InChI=1S/C18H24O4/c1-4-5-7-10-14-15(22-17(2,3)21-14)13-18(16(19)20)11-8-6-9-12-18/h8-9,11-12,14-15H,6-7,10,13H2,1-3H3,(H,19,20)/t14-,15-/m0/s1