2-azanyl-3-[[4-(3-methoxy-3-oxidanylidene-propyl)phenyl]carbonylamino]propanoic acid

Systemtic Name: 2-azanyl-3-[[4-(3-methoxy-3-oxidanylidene-propyl)phenyl]carbonylamino]propanoic acid Openeye Name: 2-amino-3-[[4-(3-methoxy-3-oxo-propyl)benzoyl]amino]propanoic acid CAS Name: 2-amino-3-[[[4-(3-methoxy-3-oxopropyl)phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 2-amino-3-[[4-(3-methoxy-3-oxopropyl)benzoyl]amino]propanoic acid Traditional Name: 2-amino-3-[[4-(3-keto-3-methoxy-propyl)benzoyl]amino]propionic acid Formula: C14H18N2O5 MolecularWeight: 294.30312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)C(=O)NCC(C(=O)O)N

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)C(=O)NCC(C(=O)O)N

InChI

InChI=1S/C14H18N2O5/c1-21-12(17)7-4-9-2-5-10(6-3-9)13(18)16-8-11(15)14(19)20/h2-3,5-6,11H,4,7-8,15H2,1H3,(H,16,18)(H,19,20)