4-oxidanylidene-4-[[2-(propan-2-ylcarbamoyl)phenyl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[2-(propan-2-ylcarbamoyl)phenyl]amino]butanoic acid Openeye Name: 4-[2-(isopropylcarbamoyl)anilino]-4-oxo-butanoic acid CAS Name: 4-oxo-4-[2-[oxo-(propan-2-ylamino)methyl]anilino]butanoic acid IUPAC Name: 4-oxo-4-[2-(propan-2-ylcarbamoyl)anilino]butanoic acid Traditional Name: 4-[2-(isopropylcarbamoyl)anilino]-4-keto-butyric acid Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=CC=C1NC(=O)CCC(=O)O

Isomeric SMILES

CC(C)NC(=O)C1=CC=CC=C1NC(=O)CCC(=O)O

InChI

InChI=1S/C14H18N2O4/c1-9(2)15-14(20)10-5-3-4-6-11(10)16-12(17)7-8-13(18)19/h3-6,9H,7-8H2,1-2H3,(H,15,20)(H,16,17)(H,18,19)