2-[4-[2-methylpropyl(propan-2-yl)amino]-2-oxidanyl-phenyl]carbonylbenzoic acid

Systemtic Name: 2-[4-[2-methylpropyl(propan-2-yl)amino]-2-oxidanyl-phenyl]carbonylbenzoic acid Openeye Name: 2-[2-hydroxy-4-[isobutyl(isopropyl)amino]benzoyl]benzoic acid CAS Name: 2-[[2-hydroxy-4-[2-methylpropyl(propan-2-yl)amino]phenyl]-oxomethyl]benzoic acid IUPAC Name: 2-[2-hydroxy-4-[2-methylpropyl(propan-2-yl)amino]benzoyl]benzoic acid Traditional Name: 2-[2-hydroxy-4-[isobutyl(isopropyl)amino]benzoyl]benzoic acid Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C1=CC(=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O)O)C(C)C

Isomeric SMILES

CC(C)CN(C1=CC(=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O)O)C(C)C

InChI

InChI=1S/C21H25NO4/c1-13(2)12-22(14(3)4)15-9-10-18(19(23)11-15)20(24)16-7-5-6-8-17(16)21(25)26/h5-11,13-14,23H,12H2,1-4H3,(H,25,26)