1-(3,4-diethoxyphenyl)-3-(hydroxymethyl)-6,7,8-trimethoxy-4-oxidanyl-naphthalene-2-carboxylic acid

Systemtic Name: 1-(3,4-diethoxyphenyl)-3-(hydroxymethyl)-6,7,8-trimethoxy-4-oxidanyl-naphthalene-2-carboxylic acid Openeye Name: 1-(3,4-diethoxyphenyl)-4-hydroxy-3-(hydroxymethyl)-6,7,8-trimethoxy-naphthalene-2-carboxylic acid CAS Name: 1-(3,4-diethoxyphenyl)-4-hydroxy-3-(hydroxymethyl)-6,7,8-trimethoxy-2-naphthalenecarboxylic acid IUPAC Name: 1-(3,4-diethoxyphenyl)-4-hydroxy-3-(hydroxymethyl)-6,7,8-trimethoxynaphthalene-2-carboxylic acid Traditional Name: 1-(3,4-diethoxyphenyl)-4-hydroxy-6,7,8-trimethoxy-3-methylol-2-naphthoic acid Formula: C25H28O9 MolecularWeight: 472.48442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=C(C(=C(C3=CC(=C(C(=C32)OC)OC)OC)O)CO)C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=C(C(=C(C3=CC(=C(C(=C32)OC)OC)OC)O)CO)C(=O)O)OCC

InChI

InChI=1S/C25H28O9/c1-6-33-16-9-8-13(10-17(16)34-7-2)19-20-14(22(27)15(12-26)21(19)25(28)29)11-18(30-3)23(31-4)24(20)32-5/h8-11,26-27H,6-7,12H2,1-5H3,(H,28,29)