2-[(4-tert-butylphenyl)carbonylamino]-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: 2-[(4-tert-butylphenyl)carbonylamino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 2-[(4-tert-butylbenzoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-[(4-tert-butylbenzoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 2-[(4-tert-butylbenzoyl)amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C17H21N3O3/c1-17(2,3)12-6-4-11(5-7-12)15(21)20-14(16(22)23)8-13-9-18-10-19-13/h4-7,9-10,14H,8H2,1-3H3,(H,18,19)(H,20,21)(H,22,23)