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

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(1-octylbenzimidazol-2-yl)butanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-4-(1-octylbenzimidazol-2-yl)butanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-(1-octyl-2-benzimidazolyl)butanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(1-octylbenzimidazol-2-yl)butanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-4-(1-octylbenzimidazol-2-yl)butyric acid Formula: C24H37N3O4 MolecularWeight: 431.56828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=CC=CC=C2N=C1CCC(C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCN1C2=CC=CC=C2N=C1CCC(C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H37N3O4/c1-5-6-7-8-9-12-17-27-20-14-11-10-13-18(20)25-21(27)16-15-19(22(28)29)26-23(30)31-24(2,3)4/h10-11,13-14,19H,5-9,12,15-17H2,1-4H3,(H,26,30)(H,28,29)