3-(4-dimethylaminophenyl)-3-(4-methoxyphenyl)-2-methyl-4-oxidanyl-2-phenoxy-butanoic acid

Systemtic Name: 3-(4-dimethylaminophenyl)-3-(4-methoxyphenyl)-2-methyl-4-oxidanyl-2-phenoxy-butanoic acid Openeye Name: 3-(4-dimethylaminophenyl)-4-hydroxy-3-(4-methoxyphenyl)-2-methyl-2-phenoxy-butanoic acid CAS Name: 3-(4-dimethylaminophenyl)-4-hydroxy-3-(4-methoxyphenyl)-2-methyl-2-phenoxybutanoic acid IUPAC Name: 3-(4-dimethylaminophenyl)-4-hydroxy-3-(4-methoxyphenyl)-2-methyl-2-phenoxybutanoic acid Traditional Name: 3-(4-dimethylaminophenyl)-4-hydroxy-3-(4-methoxyphenyl)-2-methyl-2-phenoxy-butyric acid Formula: C26H29NO5 MolecularWeight: 435.51216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)(C(CO)(C1=CC=C(C=C1)N(C)C)C2=CC=C(C=C2)OC)OC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)O)(C(CO)(C1=CC=C(C=C1)N(C)C)C2=CC=C(C=C2)OC)OC3=CC=CC=C3

InChI

InChI=1S/C26H29NO5/c1-25(24(29)30,32-23-8-6-5-7-9-23)26(18-28,20-12-16-22(31-4)17-13-20)19-10-14-21(15-11-19)27(2)3/h5-17,28H,18H2,1-4H3,(H,29,30)