3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-4-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]butanoic acid

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-4-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]butanoic acid Openeye Name: 3-(tert-butoxycarbonylamino)-4-oxo-4-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]butanoic acid CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxo-4-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]butanoic acid IUPAC Name: 3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxo-4-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]butanoic acid Traditional Name: 3-(tert-butoxycarbonylamino)-4-keto-4-[4-(2-keto-3H-benzimidazol-1-yl)piperidino]butyric acid Formula: C21H28N4O6 MolecularWeight: 432.47022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)O)C(=O)N1CCC(CC1)N2C3=CC=CC=C3NC2=O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC(=O)O)C(=O)N1CCC(CC1)N2C3=CC=CC=C3NC2=O

InChI

InChI=1S/C21H28N4O6/c1-21(2,3)31-20(30)23-15(12-17(26)27)18(28)24-10-8-13(9-11-24)25-16-7-5-4-6-14(16)22-19(25)29/h4-7,13,15H,8-12H2,1-3H3,(H,22,29)(H,23,30)(H,26,27)