methyl 3-hexyl-5-methanoyl-2,4-bis(oxidanyl)-6-propyl-benzoate

Systemtic Name: methyl 3-hexyl-5-methanoyl-2,4-bis(oxidanyl)-6-propyl-benzoate Openeye Name: methyl 5-formyl-3-hexyl-2,4-dihydroxy-6-propyl-benzoate CAS Name: 5-formyl-3-hexyl-2,4-dihydroxy-6-propylbenzoic acid methyl ester IUPAC Name: methyl 5-formyl-3-hexyl-2,4-dihydroxy-6-propylbenzoate Traditional Name: 5-formyl-3-hexyl-2,4-dihydroxy-6-propyl-benzoic acid methyl ester Formula: C18H26O5 MolecularWeight: 322.39604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=C(C(=C1O)C(=O)OC)CCC)C=O)O

Isomeric SMILES

CCCCCCC1=C(C(=C(C(=C1O)C(=O)OC)CCC)C=O)O

InChI

InChI=1S/C18H26O5/c1-4-6-7-8-10-13-16(20)14(11-19)12(9-5-2)15(17(13)21)18(22)23-3/h11,20-21H,4-10H2,1-3H3