(4-pyrazol-1-ylphenyl)methyl 1-methylpyrrole-2-carboxylate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 1-methylpyrrole-2-carboxylate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 1-methylpyrrole-2-carboxylate CAS Name: 1-methyl-2-pyrrolecarboxylic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 1-methylpyrrole-2-carboxylate Traditional Name: 1-methylpyrrole-2-carboxylic acid (4-pyrazol-1-ylbenzyl) ester Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CN1C=CC=C1C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C16H15N3O2/c1-18-10-2-4-15(18)16(20)21-12-13-5-7-14(8-6-13)19-11-3-9-17-19/h2-11H,12H2,1H3