(2S)-2-(2-azanylethoxy)-3-[1-(4-tert-butylphenyl)imidazol-4-yl]propanoic acid

Systemtic Name: (2S)-2-(2-azanylethoxy)-3-[1-(4-tert-butylphenyl)imidazol-4-yl]propanoic acid Openeye Name: (2S)-2-(2-aminoethoxy)-3-[1-(4-tert-butylphenyl)imidazol-4-yl]propanoic acid CAS Name: (2S)-2-(2-aminoethoxy)-3-[1-(4-tert-butylphenyl)-4-imidazolyl]propanoic acid IUPAC Name: (2S)-2-(2-aminoethoxy)-3-[1-(4-tert-butylphenyl)imidazol-4-yl]propanoic acid Traditional Name: (2S)-2-(2-aminoethoxy)-3-[1-(4-tert-butylphenyl)imidazol-4-yl]propionic acid Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C=C(N=C2)CC(C(=O)O)OCCN

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C=C(N=C2)C[C@@H](C(=O)O)OCCN

InChI

InChI=1S/C18H25N3O3/c1-18(2,3)13-4-6-15(7-5-13)21-11-14(20-12-21)10-16(17(22)23)24-9-8-19/h4-7,11-12,16H,8-10,19H2,1-3H3,(H,22,23)/t16-/m0/s1