4-[[2,6-di(propan-2-yl)phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[2,6-di(propan-2-yl)phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(2,6-diisopropylanilino)-4-oxo-butanoic acid CAS Name: 4-[2,6-di(propan-2-yl)anilino]-4-oxobutanoic acid IUPAC Name: 4-[2,6-di(propan-2-yl)anilino]-4-oxobutanoic acid Traditional Name: 4-(2,6-diisopropylanilino)-4-keto-butyric acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CCC(=O)O

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CCC(=O)O

InChI

InChI=1S/C16H23NO3/c1-10(2)12-6-5-7-13(11(3)4)16(12)17-14(18)8-9-15(19)20/h5-7,10-11H,8-9H2,1-4H3,(H,17,18)(H,19,20)