methyl 1-(2-cyanoethyl)-3-naphthalen-2-yl-pyrazole-4-carboxylate

Systemtic Name: methyl 1-(2-cyanoethyl)-3-naphthalen-2-yl-pyrazole-4-carboxylate Openeye Name: methyl 1-(2-cyanoethyl)-3-(2-naphthyl)pyrazole-4-carboxylate CAS Name: 1-(2-cyanoethyl)-3-(2-naphthalenyl)-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-cyanoethyl)-3-naphthalen-2-ylpyrazole-4-carboxylate Traditional Name: 1-(2-cyanoethyl)-3-(2-naphthyl)pyrazole-4-carboxylic acid methyl ester Formula: C18H15N3O2 MolecularWeight: 305.3306

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(N=C1C2=CC3=CC=CC=C3C=C2)CCC#N

Isomeric SMILES

COC(=O)C1=CN(N=C1C2=CC3=CC=CC=C3C=C2)CCC#N

InChI

InChI=1S/C18H15N3O2/c1-23-18(22)16-12-21(10-4-9-19)20-17(16)15-8-7-13-5-2-3-6-14(13)11-15/h2-3,5-8,11-12H,4,10H2,1H3