methyl 4-[3-(3-methanoyl-2-oxidanyl-phenyl)propyl]benzoate

Systemtic Name: methyl 4-[3-(3-methanoyl-2-oxidanyl-phenyl)propyl]benzoate Openeye Name: methyl 4-[3-(3-formyl-2-hydroxy-phenyl)propyl]benzoate CAS Name: 4-[3-(3-formyl-2-hydroxyphenyl)propyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(3-formyl-2-hydroxyphenyl)propyl]benzoate Traditional Name: 4-[3-(3-formyl-2-hydroxy-phenyl)propyl]benzoic acid methyl ester Formula: C18H18O4 MolecularWeight: 298.33312

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCCC2=CC=CC(=C2O)C=O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCCC2=CC=CC(=C2O)C=O

InChI

InChI=1S/C18H18O4/c1-22-18(21)15-10-8-13(9-11-15)4-2-5-14-6-3-7-16(12-19)17(14)20/h3,6-12,20H,2,4-5H2,1H3