2-ethoxy-3-(ethylamino)-6-(4-hydroxyphenyl)-4-methoxy-5-methyl-5-(2-methylphenyl)-6-oxidanyl-cyclohexa-1,3-diene-1-carboxylic acid

Systemtic Name: 2-ethoxy-3-(ethylamino)-6-(4-hydroxyphenyl)-4-methoxy-5-methyl-5-(2-methylphenyl)-6-oxidanyl-cyclohexa-1,3-diene-1-carboxylic acid Openeye Name: 2-ethoxy-3-(ethylamino)-6-hydroxy-6-(4-hydroxyphenyl)-4-methoxy-5-methyl-5-(o-tolyl)cyclohexa-1,3-diene-1-carboxylic acid CAS Name: 2-ethoxy-3-(ethylamino)-6-hydroxy-6-(4-hydroxyphenyl)-4-methoxy-5-methyl-5-(2-methylphenyl)-1-cyclohexa-1,3-dienecarboxylic acid IUPAC Name: 2-ethoxy-3-(ethylamino)-6-hydroxy-6-(4-hydroxyphenyl)-4-methoxy-5-methyl-5-(2-methylphenyl)cyclohexa-1,3-diene-1-carboxylic acid Traditional Name: 2-ethoxy-3-(ethylamino)-6-hydroxy-6-(4-hydroxyphenyl)-4-methoxy-5-methyl-5-(o-tolyl)cyclohexa-1,3-diene-1-carboxylic acid Formula: C26H31NO6 MolecularWeight: 453.52744

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C(C(C(=C1OCC)C(=O)O)(C2=CC=C(C=C2)O)O)(C)C3=CC=CC=C3C)OC

Isomeric SMILES

CCNC1=C(C(C(C(=C1OCC)C(=O)O)(C2=CC=C(C=C2)O)O)(C)C3=CC=CC=C3C)OC

InChI

InChI=1S/C26H31NO6/c1-6-27-21-22(33-7-2)20(24(29)30)26(31,17-12-14-18(28)15-13-17)25(4,23(21)32-5)19-11-9-8-10-16(19)3/h8-15,27-28,31H,6-7H2,1-5H3,(H,29,30)