ethyl 1-tert-butyl-2-(4-nitrophenyl)benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-tert-butyl-2-(4-nitrophenyl)benzimidazole-5-carboxylate Openeye Name: ethyl 1-tert-butyl-2-(4-nitrophenyl)benzimidazole-5-carboxylate CAS Name: 1-tert-butyl-2-(4-nitrophenyl)-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-tert-butyl-2-(4-nitrophenyl)benzimidazole-5-carboxylate Traditional Name: 1-tert-butyl-2-(4-nitrophenyl)benzimidazole-5-carboxylic acid ethyl ester Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(C)(C)C

InChI

InChI=1S/C20H21N3O4/c1-5-27-19(24)14-8-11-17-16(12-14)21-18(22(17)20(2,3)4)13-6-9-15(10-7-13)23(25)26/h6-12H,5H2,1-4H3