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

Systemtic Name: ethyl 1-[3-[2-[(2-chlorophenyl)carbonylamino]ethanoylamino]phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 1-[3-[[2-[(2-chlorobenzoyl)amino]acetyl]amino]phenyl]pyrazole-3-carboxylate CAS Name: 1-[3-[[2-[[(2-chlorophenyl)-oxomethyl]amino]-1-oxoethyl]amino]phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[[2-[(2-chlorobenzoyl)amino]acetyl]amino]phenyl]pyrazole-3-carboxylate Traditional Name: 1-[3-[[2-[(2-chlorobenzoyl)amino]acetyl]amino]phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C21H19ClN4O4 MolecularWeight: 426.85296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1)C2=CC(=CC=C2)NC(=O)CNC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1=NN(C=C1)C2=CC(=CC=C2)NC(=O)CNC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H19ClN4O4/c1-2-30-21(29)18-10-11-26(25-18)15-7-5-6-14(12-15)24-19(27)13-23-20(28)16-8-3-4-9-17(16)22/h3-12H,2,13H2,1H3,(H,23,28)(H,24,27)