2-[[3,5-dimethyl-4-[(4-oxidanyl-3-propan-2-yl-phenyl)methyl]phenyl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[3,5-dimethyl-4-[(4-oxidanyl-3-propan-2-yl-phenyl)methyl]phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-[(4-hydroxy-3-isopropyl-phenyl)methyl]-3,5-dimethyl-anilino]-2-oxo-acetic acid CAS Name: 2-[4-[(4-hydroxy-3-propan-2-ylphenyl)methyl]-3,5-dimethylanilino]-2-oxoacetic acid IUPAC Name: 2-[4-[(4-hydroxy-3-propan-2-ylphenyl)methyl]-3,5-dimethylanilino]-2-oxoacetic acid Traditional Name: 2-[4-(4-hydroxy-3-isopropyl-benzyl)-3,5-dimethyl-anilino]-2-keto-acetic acid Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CC2=CC(=C(C=C2)O)C(C)C)C)NC(=O)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1CC2=CC(=C(C=C2)O)C(C)C)C)NC(=O)C(=O)O

InChI

InChI=1S/C20H23NO4/c1-11(2)16-9-14(5-6-18(16)22)10-17-12(3)7-15(8-13(17)4)21-19(23)20(24)25/h5-9,11,22H,10H2,1-4H3,(H,21,23)(H,24,25)