4-(4-tert-butylphenyl)-2-[(4-methoxyphenyl)methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-tert-butylphenyl)-2-[(4-methoxyphenyl)methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-tert-butylphenyl)-2-[(4-methoxyphenyl)methylamino]-4-oxo-butanoic acid CAS Name: 4-(4-tert-butylphenyl)-2-[(4-methoxyphenyl)methylamino]-4-oxobutanoic acid IUPAC Name: 4-(4-tert-butylphenyl)-2-[(4-methoxyphenyl)methylamino]-4-oxobutanoic acid Traditional Name: 4-(4-tert-butylphenyl)-4-keto-2-(p-anisylamino)butyric acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CC(C(=O)O)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CC(C(=O)O)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C22H27NO4/c1-22(2,3)17-9-7-16(8-10-17)20(24)13-19(21(25)26)23-14-15-5-11-18(27-4)12-6-15/h5-12,19,23H,13-14H2,1-4H3,(H,25,26)