1-[2-(hydroxymethyl)-4,6-dimethoxy-phenyl]-4,5-dimethoxy-naphthalene-2-carboxylic acid

Systemtic Name: 1-[2-(hydroxymethyl)-4,6-dimethoxy-phenyl]-4,5-dimethoxy-naphthalene-2-carboxylic acid Openeye Name: 1-[2-(hydroxymethyl)-4,6-dimethoxy-phenyl]-4,5-dimethoxy-naphthalene-2-carboxylic acid CAS Name: 1-[2-(hydroxymethyl)-4,6-dimethoxyphenyl]-4,5-dimethoxy-2-naphthalenecarboxylic acid IUPAC Name: 1-[2-(hydroxymethyl)-4,6-dimethoxyphenyl]-4,5-dimethoxynaphthalene-2-carboxylic acid Traditional Name: 1-(2,4-dimethoxy-6-methylol-phenyl)-4,5-dimethoxy-2-naphthoic acid Formula: C22H22O7 MolecularWeight: 398.40588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C(C(=CC(=C21)OC)C(=O)O)C3=C(C=C(C=C3CO)OC)OC

Isomeric SMILES

COC1=CC=CC2=C(C(=CC(=C21)OC)C(=O)O)C3=C(C=C(C=C3CO)OC)OC

InChI

InChI=1S/C22H22O7/c1-26-13-8-12(11-23)19(17(9-13)28-3)20-14-6-5-7-16(27-2)21(14)18(29-4)10-15(20)22(24)25/h5-10,23H,11H2,1-4H3,(H,24,25)