3-methyl-2-[[2-oxidanylidene-2-[(4-propylphenyl)amino]ethyl]amino]butanoic acid

Systemtic Name: 3-methyl-2-[[2-oxidanylidene-2-[(4-propylphenyl)amino]ethyl]amino]butanoic acid Openeye Name: 3-methyl-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]butanoic acid CAS Name: 3-methyl-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]butanoic acid Traditional Name: 2-[[2-keto-2-(4-propylanilino)ethyl]amino]-3-methyl-butyric acid Formula: C16H24N2O3 MolecularWeight: 292.37336

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)NC(=O)CNC(C(C)C)C(=O)O

Isomeric SMILES

CCCC1=CC=C(C=C1)NC(=O)CNC(C(C)C)C(=O)O

InChI

InChI=1S/C16H24N2O3/c1-4-5-12-6-8-13(9-7-12)18-14(19)10-17-15(11(2)3)16(20)21/h6-9,11,15,17H,4-5,10H2,1-3H3,(H,18,19)(H,20,21)