ethyl 5-methyl-1-[3-(2-phenoxyphenyl)phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 5-methyl-1-[3-(2-phenoxyphenyl)phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 5-methyl-1-[3-(2-phenoxyphenyl)phenyl]pyrazole-3-carboxylate CAS Name: 5-methyl-1-[3-(2-phenoxyphenyl)phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[3-(2-phenoxyphenyl)phenyl]pyrazole-3-carboxylate Traditional Name: 5-methyl-1-[3-(2-phenoxyphenyl)phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C25H22N2O3 MolecularWeight: 398.45378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C)C2=CC=CC(=C2)C3=CC=CC=C3OC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C)C2=CC=CC(=C2)C3=CC=CC=C3OC4=CC=CC=C4

InChI

InChI=1S/C25H22N2O3/c1-3-29-25(28)23-16-18(2)27(26-23)20-11-9-10-19(17-20)22-14-7-8-15-24(22)30-21-12-5-4-6-13-21/h4-17H,3H2,1-2H3