[4-ethyl-5-methyl-2-(2-phenoxyethyl)pyrazol-3-yl] oxane-2-carboxylate

Systemtic Name: [4-ethyl-5-methyl-2-(2-phenoxyethyl)pyrazol-3-yl] oxane-2-carboxylate Openeye Name: [4-ethyl-5-methyl-2-(2-phenoxyethyl)pyrazol-3-yl] tetrahydropyran-2-carboxylate CAS Name: 2-oxanecarboxylic acid [4-ethyl-5-methyl-2-(2-phenoxyethyl)-3-pyrazolyl] ester IUPAC Name: [4-ethyl-5-methyl-2-(2-phenoxyethyl)pyrazol-3-yl] oxane-2-carboxylate Traditional Name: tetrahydropyran-2-carboxylic acid [4-ethyl-5-methyl-2-(2-phenoxyethyl)pyrazol-3-yl] ester Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(N=C1C)CCOC2=CC=CC=C2)OC(=O)C3CCCCO3

Isomeric SMILES

CCC1=C(N(N=C1C)CCOC2=CC=CC=C2)OC(=O)C3CCCCO3

InChI

InChI=1S/C20H26N2O4/c1-3-17-15(2)21-22(12-14-24-16-9-5-4-6-10-16)19(17)26-20(23)18-11-7-8-13-25-18/h4-6,9-10,18H,3,7-8,11-14H2,1-2H3