3-[[4-[(3-chloranyl-2,2-dimethyl-propanoyl)amino]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[(3-chloranyl-2,2-dimethyl-propanoyl)amino]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[(3-chloro-2,2-dimethyl-propanoyl)amino]benzoyl]amino]propanoic acid CAS Name: 3-[[[4-[(3-chloro-2,2-dimethyl-1-oxopropyl)amino]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[4-[(3-chloro-2,2-dimethylpropanoyl)amino]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[(3-chloro-2,2-dimethyl-propanoyl)amino]benzoyl]amino]propionic acid Formula: C15H19ClN2O4 MolecularWeight: 326.77536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCl)C(=O)NC1=CC=C(C=C1)C(=O)NCCC(=O)O

Isomeric SMILES

CC(C)(CCl)C(=O)NC1=CC=C(C=C1)C(=O)NCCC(=O)O

InChI

InChI=1S/C15H19ClN2O4/c1-15(2,9-16)14(22)18-11-5-3-10(4-6-11)13(21)17-8-7-12(19)20/h3-6H,7-9H2,1-2H3,(H,17,21)(H,18,22)(H,19,20)