methyl 4-[[2-imidazol-1-yl-1-(3-nitrophenyl)ethoxy]methyl]benzoate

Systemtic Name: methyl 4-[[2-imidazol-1-yl-1-(3-nitrophenyl)ethoxy]methyl]benzoate Openeye Name: methyl 4-[[2-imidazol-1-yl-1-(3-nitrophenyl)ethoxy]methyl]benzoate CAS Name: 4-[[2-(1-imidazolyl)-1-(3-nitrophenyl)ethoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-imidazol-1-yl-1-(3-nitrophenyl)ethoxy]methyl]benzoate Traditional Name: 4-[[2-imidazol-1-yl-1-(3-nitrophenyl)ethoxy]methyl]benzoic acid methyl ester Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC(CN2C=CN=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC(CN2C=CN=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O5/c1-27-20(24)16-7-5-15(6-8-16)13-28-19(12-22-10-9-21-14-22)17-3-2-4-18(11-17)23(25)26/h2-11,14,19H,12-13H2,1H3