4-oxidanylidene-4-[[3-(propan-2-ylcarbamoyl)phenyl]amino]butanoate

Systemtic Name: 4-oxidanylidene-4-[[3-(propan-2-ylcarbamoyl)phenyl]amino]butanoate Openeye Name: 4-[3-(isopropylcarbamoyl)anilino]-4-oxo-butanoate CAS Name: 4-oxo-4-[3-[oxo-(propan-2-ylamino)methyl]anilino]butanoate IUPAC Name: 4-oxo-4-[3-(propan-2-ylcarbamoyl)anilino]butanoate Traditional Name: 4-[3-(isopropylcarbamoyl)anilino]-4-keto-butyrate Formula: C14H17N2O4- MolecularWeight: 277.29578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC(=CC=C1)NC(=O)CCC(=O)[O-]

Isomeric SMILES

CC(C)NC(=O)C1=CC(=CC=C1)NC(=O)CCC(=O)[O-]

InChI

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