3-[(3-methoxyphenyl)-(3-methylbutanoyl)amino]propanoic acid

Systemtic Name: 3-[(3-methoxyphenyl)-(3-methylbutanoyl)amino]propanoic acid Openeye Name: 3-[3-methoxy-N-(3-methylbutanoyl)anilino]propanoic acid CAS Name: 3-(3-methoxy-N-(3-methyl-1-oxobutyl)anilino)propanoic acid IUPAC Name: 3-[3-methoxy-N-(3-methylbutanoyl)anilino]propanoic acid Traditional Name: 3-(N-isovaleryl-3-methoxy-anilino)propionic acid Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N(CCC(=O)O)C1=CC(=CC=C1)OC

Isomeric SMILES

CC(C)CC(=O)N(CCC(=O)O)C1=CC(=CC=C1)OC

InChI

InChI=1S/C15H21NO4/c1-11(2)9-14(17)16(8-7-15(18)19)12-5-4-6-13(10-12)20-3/h4-6,10-11H,7-9H2,1-3H3,(H,18,19)