3-[(4-methoxyphenyl)methyl]-5-(2-nitrophenyl)carbonyl-1,2,3-triazole-4-carboxylate

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-5-(2-nitrophenyl)carbonyl-1,2,3-triazole-4-carboxylate Openeye Name: 3-[(4-methoxyphenyl)methyl]-5-(2-nitrobenzoyl)triazole-4-carboxylate CAS Name: 3-[(4-methoxyphenyl)methyl]-5-[(2-nitrophenyl)-oxomethyl]-4-triazolecarboxylate IUPAC Name: 3-[(4-methoxyphenyl)methyl]-5-(2-nitrobenzoyl)triazole-4-carboxylate Traditional Name: 5-(2-nitrobenzoyl)-3-p-anisyl-triazole-4-carboxylate Formula: C18H13N4O6- MolecularWeight: 381.31902

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)C3=CC=CC=C3[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)C3=CC=CC=C3[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C18H14N4O6/c1-28-12-8-6-11(7-9-12)10-21-16(18(24)25)15(19-20-21)17(23)13-4-2-3-5-14(13)22(26)27/h2-9H,10H2,1H3,(H,24,25)/p-1