3-cyanopropyl 4-methoxy-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: 3-cyanopropyl 4-methoxy-1-phenyl-pyrazole-3-carboxylate Openeye Name: 3-cyanopropyl 4-methoxy-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-methoxy-1-phenyl-3-pyrazolecarboxylic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 4-methoxy-1-phenylpyrazole-3-carboxylate Traditional Name: 4-methoxy-1-phenyl-pyrazole-3-carboxylic acid 3-cyanopropyl ester Formula: C15H15N3O3 MolecularWeight: 285.2979

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)OCCCC#N)C2=CC=CC=C2

Isomeric SMILES

COC1=CN(N=C1C(=O)OCCCC#N)C2=CC=CC=C2

InChI

InChI=1S/C15H15N3O3/c1-20-13-11-18(12-7-3-2-4-8-12)17-14(13)15(19)21-10-6-5-9-16/h2-4,7-8,11H,5-6,10H2,1H3