1-(3,4-dimethoxyphenyl)-3-(hydroxymethyl)-6,7-dimethoxy-4-oxidanyl-naphthalene-2-carboxylic acid

Systemtic Name: 1-(3,4-dimethoxyphenyl)-3-(hydroxymethyl)-6,7-dimethoxy-4-oxidanyl-naphthalene-2-carboxylic acid Openeye Name: 1-(3,4-dimethoxyphenyl)-4-hydroxy-3-(hydroxymethyl)-6,7-dimethoxy-naphthalene-2-carboxylic acid CAS Name: 1-(3,4-dimethoxyphenyl)-4-hydroxy-3-(hydroxymethyl)-6,7-dimethoxy-2-naphthalenecarboxylic acid IUPAC Name: 1-(3,4-dimethoxyphenyl)-4-hydroxy-3-(hydroxymethyl)-6,7-dimethoxynaphthalene-2-carboxylic acid Traditional Name: 1-(3,4-dimethoxyphenyl)-4-hydroxy-6,7-dimethoxy-3-methylol-2-naphthoic acid Formula: C22H22O8 MolecularWeight: 414.40528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=C(C3=CC(=C(C=C32)OC)OC)O)CO)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=C(C3=CC(=C(C=C32)OC)OC)O)CO)C(=O)O)OC

InChI

InChI=1S/C22H22O8/c1-27-15-6-5-11(7-16(15)28-2)19-12-8-17(29-3)18(30-4)9-13(12)21(24)14(10-23)20(19)22(25)26/h5-9,23-24H,10H2,1-4H3,(H,25,26)