ethyl 4-butyl-1-(3-methoxyphenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 4-butyl-1-(3-methoxyphenyl)pyrazole-3-carboxylate Openeye Name: ethyl 4-butyl-1-(3-methoxyphenyl)pyrazole-3-carboxylate CAS Name: 4-butyl-1-(3-methoxyphenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-butyl-1-(3-methoxyphenyl)pyrazole-3-carboxylate Traditional Name: 4-butyl-1-(3-methoxyphenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN(N=C1C(=O)OCC)C2=CC(=CC=C2)OC

Isomeric SMILES

CCCCC1=CN(N=C1C(=O)OCC)C2=CC(=CC=C2)OC

InChI

InChI=1S/C17H22N2O3/c1-4-6-8-13-12-19(18-16(13)17(20)22-5-2)14-9-7-10-15(11-14)21-3/h7,9-12H,4-6,8H2,1-3H3