ethyl 5-(3,3-diphenylpropanoylamino)-1-quinolin-2-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(3,3-diphenylpropanoylamino)-1-quinolin-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 5-(3,3-diphenylpropanoylamino)-1-(2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[(1-oxo-3,3-diphenylpropyl)amino]-1-(2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3,3-diphenylpropanoylamino)-1-quinolin-2-ylpyrazole-4-carboxylate Traditional Name: 5-(3,3-diphenylpropanoylamino)-1-(2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C30H26N4O3 MolecularWeight: 490.55244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H26N4O3/c1-2-37-30(36)25-20-31-34(27-18-17-23-15-9-10-16-26(23)32-27)29(25)33-28(35)19-24(21-11-5-3-6-12-21)22-13-7-4-8-14-22/h3-18,20,24H,2,19H2,1H3,(H,33,35)