tert-butyl 2-[1-(3-nitrophenyl)ethenyl]imidazole-1-carboxylate

Systemtic Name: tert-butyl 2-[1-(3-nitrophenyl)ethenyl]imidazole-1-carboxylate Openeye Name: tert-butyl 2-[1-(3-nitrophenyl)vinyl]imidazole-1-carboxylate CAS Name: 2-[1-(3-nitrophenyl)ethenyl]-1-imidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[1-(3-nitrophenyl)ethenyl]imidazole-1-carboxylate Traditional Name: 2-[1-(3-nitrophenyl)vinyl]imidazole-1-carboxylic acid tert-butyl ester Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CN=C1C(=C)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CN=C1C(=C)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O4/c1-11(12-6-5-7-13(10-12)19(21)22)14-17-8-9-18(14)15(20)23-16(2,3)4/h5-10H,1H2,2-4H3