2-[[5-[[(2-azanyl-3-phenyl-propanoyl)amino]methyl]-1,2-oxazol-3-yl]-propanoyl-amino]ethanoic acid

Systemtic Name: 2-[[5-[[(2-azanyl-3-phenyl-propanoyl)amino]methyl]-1,2-oxazol-3-yl]-propanoyl-amino]ethanoic acid Openeye Name: 2-[[5-[[(2-amino-3-phenyl-propanoyl)amino]methyl]isoxazol-3-yl]-propanoyl-amino]acetic acid CAS Name: 2-[[5-[[(2-amino-1-oxo-3-phenylpropyl)amino]methyl]-3-isoxazolyl]-(1-oxopropyl)amino]acetic acid IUPAC Name: 2-[[5-[[(2-amino-3-phenylpropanoyl)amino]methyl]-1,2-oxazol-3-yl]-propanoylamino]acetic acid Traditional Name: 2-[[5-[(phenylalanylamino)methyl]isoxazol-3-yl]-propionyl-amino]acetic acid Formula: C18H22N4O5 MolecularWeight: 374.39108

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC(=O)O)C1=NOC(=C1)CNC(=O)C(CC2=CC=CC=C2)N

Isomeric SMILES

CCC(=O)N(CC(=O)O)C1=NOC(=C1)CNC(=O)C(CC2=CC=CC=C2)N

InChI

InChI=1S/C18H22N4O5/c1-2-16(23)22(11-17(24)25)15-9-13(27-21-15)10-20-18(26)14(19)8-12-6-4-3-5-7-12/h3-7,9,14H,2,8,10-11,19H2,1H3,(H,20,26)(H,24,25)