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

Systemtic Name: 1-(3,4-dimethoxyphenyl)-3-(hydroxymethyl)-7-methyl-4-oxidanyl-naphthalene-2-carboxylic acid Openeye Name: 1-(3,4-dimethoxyphenyl)-4-hydroxy-3-(hydroxymethyl)-7-methyl-naphthalene-2-carboxylic acid CAS Name: 1-(3,4-dimethoxyphenyl)-4-hydroxy-3-(hydroxymethyl)-7-methyl-2-naphthalenecarboxylic acid IUPAC Name: 1-(3,4-dimethoxyphenyl)-4-hydroxy-3-(hydroxymethyl)-7-methylnaphthalene-2-carboxylic acid Traditional Name: 1-(3,4-dimethoxyphenyl)-4-hydroxy-7-methyl-3-methylol-2-naphthoic acid Formula: C21H20O6 MolecularWeight: 368.3799

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(C(=C2C3=CC(=C(C=C3)OC)OC)C(=O)O)CO)O

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(C(=C2C3=CC(=C(C=C3)OC)OC)C(=O)O)CO)O

InChI

InChI=1S/C21H20O6/c1-11-4-6-13-14(8-11)18(19(21(24)25)15(10-22)20(13)23)12-5-7-16(26-2)17(9-12)27-3/h4-9,22-23H,10H2,1-3H3,(H,24,25)