3-[3-(phenylmethoxymethyl)imidazol-4-yl]-2-(3-phenylpropanoylamino)propanoic acid

Systemtic Name: 3-[3-(phenylmethoxymethyl)imidazol-4-yl]-2-(3-phenylpropanoylamino)propanoic acid Openeye Name: 3-[3-(benzyloxymethyl)imidazol-4-yl]-2-(3-phenylpropanoylamino)propanoic acid CAS Name: 2-[(1-oxo-3-phenylpropyl)amino]-3-[3-(phenylmethoxymethyl)-4-imidazolyl]propanoic acid IUPAC Name: 3-[3-(phenylmethoxymethyl)imidazol-4-yl]-2-(3-phenylpropanoylamino)propanoic acid Traditional Name: 3-[3-(benzoxymethyl)imidazol-4-yl]-2-(hydrocinnamoylamino)propionic acid Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC(CC2=CN=CN2COCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC(CC2=CN=CN2COCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H25N3O4/c27-22(12-11-18-7-3-1-4-8-18)25-21(23(28)29)13-20-14-24-16-26(20)17-30-15-19-9-5-2-6-10-19/h1-10,14,16,21H,11-13,15,17H2,(H,25,27)(H,28,29)