ethyl 1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxylate Openeye Name: ethyl 1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxylate CAS Name: 1-phenyl-5-(1-pyrrolyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-phenyl-5-pyrrol-1-ylpyrazole-4-carboxylate Traditional Name: 1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxylic acid ethyl ester Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)N3C=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)N3C=CC=C3

InChI

InChI=1S/C16H15N3O2/c1-2-21-16(20)14-12-17-19(13-8-4-3-5-9-13)15(14)18-10-6-7-11-18/h3-12H,2H2,1H3