ethyl 1-(1,3-benzodioxol-5-yl)-3-(hydroxymethyl)-6,7-dimethoxy-4-oxidanyl-naphthalene-2-carboxylate

Systemtic Name: ethyl 1-(1,3-benzodioxol-5-yl)-3-(hydroxymethyl)-6,7-dimethoxy-4-oxidanyl-naphthalene-2-carboxylate Openeye Name: ethyl 1-(1,3-benzodioxol-5-yl)-4-hydroxy-3-(hydroxymethyl)-6,7-dimethoxy-naphthalene-2-carboxylate CAS Name: 1-(1,3-benzodioxol-5-yl)-4-hydroxy-3-(hydroxymethyl)-6,7-dimethoxy-2-naphthalenecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1,3-benzodioxol-5-yl)-4-hydroxy-3-(hydroxymethyl)-6,7-dimethoxynaphthalene-2-carboxylate Traditional Name: 1-(1,3-benzodioxol-5-yl)-4-hydroxy-6,7-dimethoxy-3-methylol-naphthalene-2-carboxylic acid ethyl ester Formula: C23H22O8 MolecularWeight: 426.41598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2C(=C1CO)O)OC)OC)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2C(=C1CO)O)OC)OC)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H22O8/c1-4-29-23(26)21-15(10-24)22(25)14-9-18(28-3)17(27-2)8-13(14)20(21)12-5-6-16-19(7-12)31-11-30-16/h5-9,24-25H,4,10-11H2,1-3H3