(E)-2-oxidanyl-4-oxidanylidene-4-[5-[(3-propan-2-yloxyphenyl)methyl]furan-2-yl]but-2-enoic acid

Systemtic Name: (E)-2-oxidanyl-4-oxidanylidene-4-[5-[(3-propan-2-yloxyphenyl)methyl]furan-2-yl]but-2-enoic acid Openeye Name: (E)-2-hydroxy-4-[5-[(3-isopropoxyphenyl)methyl]-2-furyl]-4-oxo-but-2-enoic acid CAS Name: (E)-2-hydroxy-4-oxo-4-[5-[(3-propan-2-yloxyphenyl)methyl]-2-furanyl]-2-butenoic acid IUPAC Name: (E)-2-hydroxy-4-oxo-4-[5-[(3-propan-2-yloxyphenyl)methyl]furan-2-yl]but-2-enoic acid Traditional Name: (E)-2-hydroxy-4-[5-(3-isopropoxybenzyl)-2-furyl]-4-keto-but-2-enoic acid Formula: C18H18O6 MolecularWeight: 330.33192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)CC2=CC=C(O2)C(=O)C=C(C(=O)O)O

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)CC2=CC=C(O2)C(=O)/C=C(\C(=O)O)/O

InChI

InChI=1S/C18H18O6/c1-11(2)23-13-5-3-4-12(8-13)9-14-6-7-17(24-14)15(19)10-16(20)18(21)22/h3-8,10-11,20H,9H2,1-2H3,(H,21,22)/b16-10+