[2-oxidanylidene-2-(prop-2-enylamino)ethyl] 5-(4-chlorophenyl)-1H-pyrazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylamino)ethyl] 5-(4-chlorophenyl)-1H-pyrazole-4-carboxylate Openeye Name: [2-(allylamino)-2-oxo-ethyl] 5-(4-chlorophenyl)-1H-pyrazole-4-carboxylate CAS Name: 5-(4-chlorophenyl)-1H-pyrazole-4-carboxylic acid [2-oxo-2-(prop-2-enylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylamino)ethyl] 5-(4-chlorophenyl)-1H-pyrazole-4-carboxylate Traditional Name: 5-(4-chlorophenyl)-1H-pyrazole-4-carboxylic acid [2-(allylamino)-2-keto-ethyl] ester Formula: C15H14ClN3O3 MolecularWeight: 319.74296

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)COC(=O)C1=C(NN=C1)C2=CC=C(C=C2)Cl

Isomeric SMILES

C=CCNC(=O)COC(=O)C1=C(NN=C1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H14ClN3O3/c1-2-7-17-13(20)9-22-15(21)12-8-18-19-14(12)10-3-5-11(16)6-4-10/h2-6,8H,1,7,9H2,(H,17,20)(H,18,19)