3-[4-[[4-(2-methylpropanoylamino)phenyl]carbonylamino]phenyl]propanoic acid

Systemtic Name: 3-[4-[[4-(2-methylpropanoylamino)phenyl]carbonylamino]phenyl]propanoic acid Openeye Name: 3-[4-[[4-(2-methylpropanoylamino)benzoyl]amino]phenyl]propanoic acid CAS Name: 3-[4-[[[4-[(2-methyl-1-oxopropyl)amino]phenyl]-oxomethyl]amino]phenyl]propanoic acid IUPAC Name: 3-[4-[[4-(2-methylpropanoylamino)benzoyl]amino]phenyl]propanoic acid Traditional Name: 3-[4-[[4-(isobutyrylamino)benzoyl]amino]phenyl]propionic acid Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)CCC(=O)O

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)CCC(=O)O

InChI

InChI=1S/C20H22N2O4/c1-13(2)19(25)21-17-10-6-15(7-11-17)20(26)22-16-8-3-14(4-9-16)5-12-18(23)24/h3-4,6-11,13H,5,12H2,1-2H3,(H,21,25)(H,22,26)(H,23,24)