4-(3,5-dimethylphenyl)-6-ethoxy-5-(ethylamino)-3-(4-hydroxyphenyl)-4-methyl-3-oxidanyl-2-propan-2-yl-cyclohexa-1,5-diene-1-carboxylic acid

Systemtic Name: 4-(3,5-dimethylphenyl)-6-ethoxy-5-(ethylamino)-3-(4-hydroxyphenyl)-4-methyl-3-oxidanyl-2-propan-2-yl-cyclohexa-1,5-diene-1-carboxylic acid Openeye Name: 4-(3,5-dimethylphenyl)-6-ethoxy-5-(ethylamino)-3-hydroxy-3-(4-hydroxyphenyl)-2-isopropyl-4-methyl-cyclohexa-1,5-diene-1-carboxylic acid CAS Name: 4-(3,5-dimethylphenyl)-6-ethoxy-5-(ethylamino)-3-hydroxy-3-(4-hydroxyphenyl)-4-methyl-2-propan-2-yl-1-cyclohexa-1,5-dienecarboxylic acid IUPAC Name: 4-(3,5-dimethylphenyl)-6-ethoxy-5-(ethylamino)-3-hydroxy-3-(4-hydroxyphenyl)-4-methyl-2-propan-2-ylcyclohexa-1,5-diene-1-carboxylic acid Traditional Name: 4-(3,5-dimethylphenyl)-6-ethoxy-5-(ethylamino)-3-hydroxy-3-(4-hydroxyphenyl)-2-isopropyl-4-methyl-cyclohexa-1,5-diene-1-carboxylic acid Formula: C29H37NO5 MolecularWeight: 479.60778

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C(=C(C(C1(C)C2=CC(=CC(=C2)C)C)(C3=CC=C(C=C3)O)O)C(C)C)C(=O)O)OCC

Isomeric SMILES

CCNC1=C(C(=C(C(C1(C)C2=CC(=CC(=C2)C)C)(C3=CC=C(C=C3)O)O)C(C)C)C(=O)O)OCC

InChI

InChI=1S/C29H37NO5/c1-8-30-26-25(35-9-2)23(27(32)33)24(17(3)4)29(34,20-10-12-22(31)13-11-20)28(26,7)21-15-18(5)14-19(6)16-21/h10-17,30-31,34H,8-9H2,1-7H3,(H,32,33)