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

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(1-phenylbenzimidazol-2-yl)butanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-4-(1-phenylbenzimidazol-2-yl)butanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-(1-phenyl-2-benzimidazolyl)butanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(1-phenylbenzimidazol-2-yl)butanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-4-(1-phenylbenzimidazol-2-yl)butyric acid Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC1=NC2=CC=CC=C2N1C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCC1=NC2=CC=CC=C2N1C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H25N3O4/c1-22(2,3)29-21(28)24-17(20(26)27)13-14-19-23-16-11-7-8-12-18(16)25(19)15-9-5-4-6-10-15/h4-12,17H,13-14H2,1-3H3,(H,24,28)(H,26,27)