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

Systemtic Name: 2-(phenethylsulfonylamino)-3-[3-(phenylmethoxymethyl)imidazol-4-yl]propanoic acid Openeye Name: 3-[3-(benzyloxymethyl)imidazol-4-yl]-2-(phenethylsulfonylamino)propanoic acid CAS Name: 2-(phenethylsulfonylamino)-3-[3-(phenylmethoxymethyl)-4-imidazolyl]propanoic acid IUPAC Name: 2-(phenethylsulfonylamino)-3-[3-(phenylmethoxymethyl)imidazol-4-yl]propanoic acid Traditional Name: 3-[3-(benzoxymethyl)imidazol-4-yl]-2-(phenethylsulfonylamino)propionic acid Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O5S/c26-22(27)21(24-31(28,29)12-11-18-7-3-1-4-8-18)13-20-14-23-16-25(20)17-30-15-19-9-5-2-6-10-19/h1-10,14,16,21,24H,11-13,15,17H2,(H,26,27)