methyl 3-[4,5-dimethyl-3-(4-phenoxyphenyl)pyrazol-1-yl]propanoate

Systemtic Name: methyl 3-[4,5-dimethyl-3-(4-phenoxyphenyl)pyrazol-1-yl]propanoate Openeye Name: methyl 3-[4,5-dimethyl-3-(4-phenoxyphenyl)pyrazol-1-yl]propanoate CAS Name: 3-[4,5-dimethyl-3-(4-phenoxyphenyl)-1-pyrazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4,5-dimethyl-3-(4-phenoxyphenyl)pyrazol-1-yl]propanoate Traditional Name: 3-[4,5-dimethyl-3-(4-phenoxyphenyl)pyrazol-1-yl]propionic acid methyl ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C2=CC=C(C=C2)OC3=CC=CC=C3)CCC(=O)OC)C

Isomeric SMILES

CC1=C(N(N=C1C2=CC=C(C=C2)OC3=CC=CC=C3)CCC(=O)OC)C

InChI

InChI=1S/C21H22N2O3/c1-15-16(2)23(14-13-20(24)25-3)22-21(15)17-9-11-19(12-10-17)26-18-7-5-4-6-8-18/h4-12H,13-14H2,1-3H3