ethyl 6-methyl-8-(4-nitrophenyl)-3-phenyl-pyrrolo[1,2-b][1,2,4]triazine-7-carboxylate

Systemtic Name: ethyl 6-methyl-8-(4-nitrophenyl)-3-phenyl-pyrrolo[1,2-b][1,2,4]triazine-7-carboxylate Openeye Name: ethyl 6-methyl-8-(4-nitrophenyl)-3-phenyl-pyrrolo[1,2-b][1,2,4]triazine-7-carboxylate CAS Name: 6-methyl-8-(4-nitrophenyl)-3-phenyl-7-pyrrolo[1,2-b][1,2,4]triazinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-8-(4-nitrophenyl)-3-phenylpyrrolo[1,2-b][1,2,4]triazine-7-carboxylate Traditional Name: 6-methyl-8-(4-nitrophenyl)-3-phenyl-pyrrolo[1,2-b][1,2,4]triazine-7-carboxylic acid ethyl ester Formula: C22H18N4O4 MolecularWeight: 402.40272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N2C(=C1C3=CC=C(C=C3)[N+](=O)[O-])N=CC(=N2)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N2C(=C1C3=CC=C(C=C3)[N+](=O)[O-])N=CC(=N2)C4=CC=CC=C4)C

InChI

InChI=1S/C22H18N4O4/c1-3-30-22(27)19-14(2)25-21(20(19)16-9-11-17(12-10-16)26(28)29)23-13-18(24-25)15-7-5-4-6-8-15/h4-13H,3H2,1-2H3