[3-(2,2-dimethylbutanoyloxy)-2-oxidanyl-propyl] 3-methoxy-7-oxidanyl-naphthalene-2-carboxylate

Systemtic Name: [3-(2,2-dimethylbutanoyloxy)-2-oxidanyl-propyl] 3-methoxy-7-oxidanyl-naphthalene-2-carboxylate Openeye Name: [3-(2,2-dimethylbutanoyloxy)-2-hydroxy-propyl] 7-hydroxy-3-methoxy-naphthalene-2-carboxylate CAS Name: 7-hydroxy-3-methoxy-2-naphthalenecarboxylic acid [3-(2,2-dimethyl-1-oxobutoxy)-2-hydroxypropyl] ester IUPAC Name: [3-(2,2-dimethylbutanoyloxy)-2-hydroxypropyl] 7-hydroxy-3-methoxynaphthalene-2-carboxylate Traditional Name: 7-hydroxy-3-methoxy-naphthalene-2-carboxylic acid [3-(2,2-dimethylbutanoyloxy)-2-hydroxy-propyl] ester Formula: C21H26O7 MolecularWeight: 390.42694

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)OCC(COC(=O)C1=C(C=C2C=CC(=CC2=C1)O)OC)O

Isomeric SMILES

CCC(C)(C)C(=O)OCC(COC(=O)C1=C(C=C2C=CC(=CC2=C1)O)OC)O

InChI

InChI=1S/C21H26O7/c1-5-21(2,3)20(25)28-12-16(23)11-27-19(24)17-9-14-8-15(22)7-6-13(14)10-18(17)26-4/h6-10,16,22-23H,5,11-12H2,1-4H3