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

Systemtic Name: ethyl 1-[4-(2,2-diphenylethylcarbamoyl)phenyl]-3,5-dimethyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-(2,2-diphenylethylcarbamoyl)phenyl]-3,5-dimethyl-pyrazole-4-carboxylate CAS Name: 1-[4-[(2,2-diphenylethylamino)-oxomethyl]phenyl]-3,5-dimethyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(2,2-diphenylethylcarbamoyl)phenyl]-3,5-dimethylpyrazole-4-carboxylate Traditional Name: 1-[4-(2,2-diphenylethylcarbamoyl)phenyl]-3,5-dimethyl-pyrazole-4-carboxylic acid ethyl ester Formula: C29H29N3O3 MolecularWeight: 467.55886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)C(=O)NCC(C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)C(=O)NCC(C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C29H29N3O3/c1-4-35-29(34)27-20(2)31-32(21(27)3)25-17-15-24(16-18-25)28(33)30-19-26(22-11-7-5-8-12-22)23-13-9-6-10-14-23/h5-18,26H,4,19H2,1-3H3,(H,30,33)