dimethyl 1-(phenylmethyl)-2-propan-2-yl-benzimidazole-5,6-dicarboxylate

Systemtic Name: dimethyl 1-(phenylmethyl)-2-propan-2-yl-benzimidazole-5,6-dicarboxylate Openeye Name: dimethyl 1-benzyl-2-isopropyl-benzimidazole-5,6-dicarboxylate CAS Name: 1-(phenylmethyl)-2-propan-2-ylbenzimidazole-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-benzyl-2-propan-2-ylbenzimidazole-5,6-dicarboxylate Traditional Name: 1-benzyl-2-isopropyl-benzimidazole-5,6-dicarboxylic acid dimethyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(N1CC3=CC=CC=C3)C=C(C(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)C1=NC2=C(N1CC3=CC=CC=C3)C=C(C(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H22N2O4/c1-13(2)19-22-17-10-15(20(24)26-3)16(21(25)27-4)11-18(17)23(19)12-14-8-6-5-7-9-14/h5-11,13H,12H2,1-4H3