dimethyl 2-(methoxymethyl)-1-[(4-nitrophenyl)methyl]imidazole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-(methoxymethyl)-1-[(4-nitrophenyl)methyl]imidazole-4,5-dicarboxylate Openeye Name: dimethyl 2-(methoxymethyl)-1-[(4-nitrophenyl)methyl]imidazole-4,5-dicarboxylate CAS Name: 2-(methoxymethyl)-1-[(4-nitrophenyl)methyl]imidazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(methoxymethyl)-1-[(4-nitrophenyl)methyl]imidazole-4,5-dicarboxylate Traditional Name: 2-(methoxymethyl)-1-(4-nitrobenzyl)imidazole-4,5-dicarboxylic acid dimethyl ester Formula: C16H17N3O7 MolecularWeight: 363.32208

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NC(=C(N1CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC)C(=O)OC

Isomeric SMILES

COCC1=NC(=C(N1CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC)C(=O)OC

InChI

InChI=1S/C16H17N3O7/c1-24-9-12-17-13(15(20)25-2)14(16(21)26-3)18(12)8-10-4-6-11(7-5-10)19(22)23/h4-7H,8-9H2,1-3H3