2-heptyl-4-(4-methoxy-2-methyl-6-oxidanyl-phenyl)carbonyloxy-6-oxidanyl-benzoic acid

Systemtic Name: 2-heptyl-4-(4-methoxy-2-methyl-6-oxidanyl-phenyl)carbonyloxy-6-oxidanyl-benzoic acid Openeye Name: 2-heptyl-6-hydroxy-4-(2-hydroxy-4-methoxy-6-methyl-benzoyl)oxy-benzoic acid CAS Name: 2-heptyl-6-hydroxy-4-[(2-hydroxy-4-methoxy-6-methylphenyl)-oxomethoxy]benzoic acid IUPAC Name: 2-heptyl-6-hydroxy-4-(2-hydroxy-4-methoxy-6-methylbenzoyl)oxybenzoic acid Traditional Name: 2-heptyl-6-hydroxy-4-(2-hydroxy-4-methoxy-6-methyl-benzoyl)oxy-benzoic acid Formula: C23H28O7 MolecularWeight: 416.46422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=CC(=C1C(=O)O)O)OC(=O)C2=C(C=C(C=C2C)OC)O

Isomeric SMILES

CCCCCCCC1=CC(=CC(=C1C(=O)O)O)OC(=O)C2=C(C=C(C=C2C)OC)O

InChI

InChI=1S/C23H28O7/c1-4-5-6-7-8-9-15-11-17(13-19(25)21(15)22(26)27)30-23(28)20-14(2)10-16(29-3)12-18(20)24/h10-13,24-25H,4-9H2,1-3H3,(H,26,27)