ethyl 1-[4-(1,2-diphenylethylcarbamoyl)phenyl]-5-methyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-[4-(1,2-diphenylethylcarbamoyl)phenyl]-5-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 1-[4-(1,2-diphenylethylcarbamoyl)phenyl]-5-methyl-pyrazole-3-carboxylate CAS Name: 1-[4-[(1,2-diphenylethylamino)-oxomethyl]phenyl]-5-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(1,2-diphenylethylcarbamoyl)phenyl]-5-methylpyrazole-3-carboxylate Traditional Name: 1-[4-(1,2-diphenylethylcarbamoyl)phenyl]-5-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C)C2=CC=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C)C2=CC=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H27N3O3/c1-3-34-28(33)26-18-20(2)31(30-26)24-16-14-23(15-17-24)27(32)29-25(22-12-8-5-9-13-22)19-21-10-6-4-7-11-21/h4-18,25H,3,19H2,1-2H3,(H,29,32)