ethyl 1,2-dimethyl-4-[(4-nitrophenyl)diazenyl]-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1,2-dimethyl-4-[(4-nitrophenyl)diazenyl]-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 1,2-dimethyl-4-(4-nitrophenyl)azo-5-phenyl-pyrrole-3-carboxylate CAS Name: 1,2-dimethyl-4-(4-nitrophenyl)azo-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1,2-dimethyl-4-[(4-nitrophenyl)diazenyl]-5-phenylpyrrole-3-carboxylate Traditional Name: 1,2-dimethyl-4-(4-nitrophenyl)azo-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1N=NC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1N=NC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C)C

InChI

InChI=1S/C21H20N4O4/c1-4-29-21(26)18-14(2)24(3)20(15-8-6-5-7-9-15)19(18)23-22-16-10-12-17(13-11-16)25(27)28/h5-13H,4H2,1-3H3