ethyl 1-[3-[2-(2-phenylethanoylamino)ethanoylamino]phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-[3-[2-(2-phenylethanoylamino)ethanoylamino]phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 1-[3-[[2-[(2-phenylacetyl)amino]acetyl]amino]phenyl]pyrazole-3-carboxylate CAS Name: 1-[3-[[1-oxo-2-[(1-oxo-2-phenylethyl)amino]ethyl]amino]phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[[2-[(2-phenylacetyl)amino]acetyl]amino]phenyl]pyrazole-3-carboxylate Traditional Name: 1-[3-[[2-[(2-phenylacetyl)amino]acetyl]amino]phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O4/c1-2-30-22(29)19-11-12-26(25-19)18-10-6-9-17(14-18)24-21(28)15-23-20(27)13-16-7-4-3-5-8-16/h3-12,14H,2,13,15H2,1H3,(H,23,27)(H,24,28)