5-[[5-chloranyl-2-(2-methylpropoxy)phenyl]methyl]-4-methyl-furan-2-carboxylic acid

Systemtic Name: 5-[[5-chloranyl-2-(2-methylpropoxy)phenyl]methyl]-4-methyl-furan-2-carboxylic acid Openeye Name: 5-[(5-chloro-2-isobutoxy-phenyl)methyl]-4-methyl-furan-2-carboxylic acid CAS Name: 5-[[5-chloro-2-(2-methylpropoxy)phenyl]methyl]-4-methyl-2-furancarboxylic acid IUPAC Name: 5-[[5-chloro-2-(2-methylpropoxy)phenyl]methyl]-4-methylfuran-2-carboxylic acid Traditional Name: 5-(5-chloro-2-isobutoxy-benzyl)-4-methyl-2-furoic acid Formula: C17H19ClO4 MolecularWeight: 322.78336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)C(=O)O)CC2=C(C=CC(=C2)Cl)OCC(C)C

Isomeric SMILES

CC1=C(OC(=C1)C(=O)O)CC2=C(C=CC(=C2)Cl)OCC(C)C

InChI

InChI=1S/C17H19ClO4/c1-10(2)9-21-14-5-4-13(18)7-12(14)8-15-11(3)6-16(22-15)17(19)20/h4-7,10H,8-9H2,1-3H3,(H,19,20)