ethyl 5-(3-azidophenyl)-1-(3-cyano-4-phenyl-1H-pyrrol-2-yl)-2-methyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(3-azidophenyl)-1-(3-cyano-4-phenyl-1H-pyrrol-2-yl)-2-methyl-pyrrole-3-carboxylate Openeye Name: ethyl 5-(3-azidophenyl)-1-(3-cyano-4-phenyl-1H-pyrrol-2-yl)-2-methyl-pyrrole-3-carboxylate CAS Name: 5-(3-azidophenyl)-1-(3-cyano-4-phenyl-1H-pyrrol-2-yl)-2-methyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-azidophenyl)-1-(3-cyano-4-phenyl-1H-pyrrol-2-yl)-2-methylpyrrole-3-carboxylate Traditional Name: 5-(3-azidophenyl)-1-(3-cyano-4-phenyl-1H-pyrrol-2-yl)-2-methyl-pyrrole-3-carboxylic acid ethyl ester Formula: C25H20N6O2 MolecularWeight: 436.4653

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC(=CC=C2)N=[N+]=[N-])C3=C(C(=CN3)C4=CC=CC=C4)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC(=CC=C2)N=[N+]=[N-])C3=C(C(=CN3)C4=CC=CC=C4)C#N)C

InChI

InChI=1S/C25H20N6O2/c1-3-33-25(32)20-13-23(18-10-7-11-19(12-18)29-30-27)31(16(20)2)24-21(14-26)22(15-28-24)17-8-5-4-6-9-17/h4-13,15,28H,3H2,1-2H3