4-[(2,5-dimethylphenyl)amino]-4-oxidanylidene-2-(oxolan-2-yl)butanoic acid

Systemtic Name: 4-[(2,5-dimethylphenyl)amino]-4-oxidanylidene-2-(oxolan-2-yl)butanoic acid Openeye Name: 4-(2,5-dimethylanilino)-4-oxo-2-tetrahydrofuran-2-yl-butanoic acid CAS Name: 4-(2,5-dimethylanilino)-4-oxo-2-(2-oxolanyl)butanoic acid IUPAC Name: 4-(2,5-dimethylanilino)-4-oxo-2-(oxolan-2-yl)butanoic acid Traditional Name: 4-(2,5-dimethylanilino)-4-keto-2-(tetrahydrofuryl)butyric acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CC(C2CCCO2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CC(C2CCCO2)C(=O)O

InChI

InChI=1S/C16H21NO4/c1-10-5-6-11(2)13(8-10)17-15(18)9-12(16(19)20)14-4-3-7-21-14/h5-6,8,12,14H,3-4,7,9H2,1-2H3,(H,17,18)(H,19,20)