4-(1H-benzimidazol-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid

Systemtic Name: 4-(1H-benzimidazol-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid Openeye Name: 4-(1H-benzimidazol-2-yl)-2-(tert-butoxycarbonylamino)butanoic acid CAS Name: 4-(1H-benzimidazol-2-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid IUPAC Name: 4-(1H-benzimidazol-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid Traditional Name: 4-(1H-benzimidazol-2-yl)-2-(tert-butoxycarbonylamino)butyric acid Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC1=NC2=CC=CC=C2N1)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCC1=NC2=CC=CC=C2N1)C(=O)O

InChI

InChI=1S/C16H21N3O4/c1-16(2,3)23-15(22)19-12(14(20)21)8-9-13-17-10-6-4-5-7-11(10)18-13/h4-7,12H,8-9H2,1-3H3,(H,17,18)(H,19,22)(H,20,21)