methyl 2-butyl-3-[[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]methyl]benzimidazole-4-carboxylate

Systemtic Name: methyl 2-butyl-3-[[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]methyl]benzimidazole-4-carboxylate Openeye Name: methyl 3-[[4-[2-(tert-butoxycarbonylamino)phenyl]phenyl]methyl]-2-butyl-benzimidazole-4-carboxylate CAS Name: 2-butyl-3-[[4-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]phenyl]methyl]-4-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-butyl-3-[[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]methyl]benzimidazole-4-carboxylate Traditional Name: 3-[4-[2-(tert-butoxycarbonylamino)phenyl]benzyl]-2-butyl-benzimidazole-4-carboxylic acid methyl ester Formula: C31H35N3O4 MolecularWeight: 513.6273

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4NC(=O)OC(C)(C)C)C(=O)OC

Isomeric SMILES

CCCCC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4NC(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C31H35N3O4/c1-6-7-15-27-32-26-14-10-12-24(29(35)37-5)28(26)34(27)20-21-16-18-22(19-17-21)23-11-8-9-13-25(23)33-30(36)38-31(2,3)4/h8-14,16-19H,6-7,15,20H2,1-5H3,(H,33,36)