ethyl 5-(3-azidophenyl)-1-(2-ethoxycarbonyl-1H-pyrrol-3-yl)-2-methyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(3-azidophenyl)-1-(2-ethoxycarbonyl-1H-pyrrol-3-yl)-2-methyl-pyrrole-3-carboxylate Openeye Name: ethyl 5-(3-azidophenyl)-1-(2-ethoxycarbonyl-1H-pyrrol-3-yl)-2-methyl-pyrrole-3-carboxylate CAS Name: 5-(3-azidophenyl)-1-(2-ethoxycarbonyl-1H-pyrrol-3-yl)-2-methyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-azidophenyl)-1-(2-ethoxycarbonyl-1H-pyrrol-3-yl)-2-methylpyrrole-3-carboxylate Traditional Name: 5-(3-azidophenyl)-1-(2-carbethoxy-1H-pyrrol-3-yl)-2-methyl-pyrrole-3-carboxylic acid ethyl ester Formula: C21H21N5O4 MolecularWeight: 407.42254

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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(NC=C3)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC(=CC=C2)N=[N+]=[N-])C3=C(NC=C3)C(=O)OCC)C

InChI

InChI=1S/C21H21N5O4/c1-4-29-20(27)16-12-18(14-7-6-8-15(11-14)24-25-22)26(13(16)3)17-9-10-23-19(17)21(28)30-5-2/h6-12,23H,4-5H2,1-3H3