3-[2-methylpropanoyl-(4-propan-2-ylphenyl)amino]propanoic acid

Systemtic Name: 3-[2-methylpropanoyl-(4-propan-2-ylphenyl)amino]propanoic acid Openeye Name: 3-[4-isopropyl-N-(2-methylpropanoyl)anilino]propanoic acid CAS Name: 3-(N-(2-methyl-1-oxopropyl)-4-propan-2-ylanilino)propanoic acid IUPAC Name: 3-[N-(2-methylpropanoyl)-4-propan-2-ylanilino]propanoic acid Traditional Name: 3-(N-isobutyryl-4-isopropyl-anilino)propionic acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO3/c1-11(2)13-5-7-14(8-6-13)17(10-9-15(18)19)16(20)12(3)4/h5-8,11-12H,9-10H2,1-4H3,(H,18,19)