2-(1-azanylpropan-2-yloxy)-3-[1-(4-phenoxyphenyl)imidazol-4-yl]propanoic acid

Systemtic Name: 2-(1-azanylpropan-2-yloxy)-3-[1-(4-phenoxyphenyl)imidazol-4-yl]propanoic acid Openeye Name: 2-(2-amino-1-methyl-ethoxy)-3-[1-(4-phenoxyphenyl)imidazol-4-yl]propanoic acid CAS Name: 2-(1-aminopropan-2-yloxy)-3-[1-(4-phenoxyphenyl)-4-imidazolyl]propanoic acid IUPAC Name: 2-(1-aminopropan-2-yloxy)-3-[1-(4-phenoxyphenyl)imidazol-4-yl]propanoic acid Traditional Name: 2-(2-amino-1-methyl-ethoxy)-3-[1-(4-phenoxyphenyl)imidazol-4-yl]propionic acid Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN)OC(CC1=CN(C=N1)C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(CN)OC(CC1=CN(C=N1)C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H23N3O4/c1-15(12-22)27-20(21(25)26)11-16-13-24(14-23-16)17-7-9-19(10-8-17)28-18-5-3-2-4-6-18/h2-10,13-15,20H,11-12,22H2,1H3,(H,25,26)