4-[1-[(4-tert-butylphenyl)methyl]benzimidazol-2-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid

Systemtic Name: 4-[1-[(4-tert-butylphenyl)methyl]benzimidazol-2-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-4-[1-[(4-tert-butylphenyl)methyl]benzimidazol-2-yl]butanoic acid CAS Name: 4-[1-[(4-tert-butylphenyl)methyl]-2-benzimidazolyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid IUPAC Name: 4-[1-[(4-tert-butylphenyl)methyl]benzimidazol-2-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-4-[1-(4-tert-butylbenzyl)benzimidazol-2-yl]butyric acid Formula: C27H35N3O4 MolecularWeight: 465.5845

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2CCC(C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2CCC(C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C27H35N3O4/c1-26(2,3)19-13-11-18(12-14-19)17-30-22-10-8-7-9-20(22)28-23(30)16-15-21(24(31)32)29-25(33)34-27(4,5)6/h7-14,21H,15-17H2,1-6H3,(H,29,33)(H,31,32)