5-azanyl-3-(4-ethoxyphenyl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-3-(4-ethoxyphenyl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-3-(4-ethoxyphenyl)-5-oxo-pentanoic acid CAS Name: 5-amino-3-(4-ethoxyphenyl)-5-oxopentanoic acid IUPAC Name: 5-amino-3-(4-ethoxyphenyl)-5-oxopentanoic acid Traditional Name: 5-amino-5-keto-3-p-phenetyl-valeric acid Formula: C13H17NO4 MolecularWeight: 251.27838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(CC(=O)N)CC(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C(CC(=O)N)CC(=O)O

InChI

InChI=1S/C13H17NO4/c1-2-18-11-5-3-9(4-6-11)10(7-12(14)15)8-13(16)17/h3-6,10H,2,7-8H2,1H3,(H2,14,15)(H,16,17)