2-azanyl-3-[1-phenylmethoxycarbonyl-3-(phenylmethoxymethyl)-2H-imidazol-4-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[1-phenylmethoxycarbonyl-3-(phenylmethoxymethyl)-2H-imidazol-4-yl]propanoic acid Openeye Name: 2-amino-3-[1-benzyloxycarbonyl-3-(benzyloxymethyl)-2H-imidazol-4-yl]propanoic acid CAS Name: 2-amino-3-[1-phenylmethoxycarbonyl-3-(phenylmethoxymethyl)-2H-imidazol-4-yl]propanoic acid IUPAC Name: 2-amino-3-[1-phenylmethoxycarbonyl-3-(phenylmethoxymethyl)-2H-imidazol-4-yl]propanoic acid Traditional Name: 2-amino-3-[3-(benzoxymethyl)-1-carbobenzoxy-4-imidazolin-4-yl]propionic acid Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C=C(N1COCC2=CC=CC=C2)CC(C(=O)O)N)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1N(C=C(N1COCC2=CC=CC=C2)CC(C(=O)O)N)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O5/c23-20(21(26)27)11-19-12-24(22(28)30-14-18-9-5-2-6-10-18)15-25(19)16-29-13-17-7-3-1-4-8-17/h1-10,12,20H,11,13-16,23H2,(H,26,27)