(5E)-5-(3-chloranyl-4-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-N-ethyl-4-piperazin-1-yl-1,2-dihydropyrazole-3-carboxamide

Systemtic Name: (5E)-5-(3-chloranyl-4-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-N-ethyl-4-piperazin-1-yl-1,2-dihydropyrazole-3-carboxamide Openeye Name: (5E)-5-(3-chloro-4-hydroxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)-N-ethyl-4-piperazin-1-yl-1,2-dihydropyrazole-3-carboxamide CAS Name: (5E)-5-(3-chloro-4-hydroxy-6-oxo-1-cyclohexa-2,4-dienylidene)-N-ethyl-4-(1-piperazinyl)-1,2-dihydropyrazole-3-carboxamide IUPAC Name: (5E)-5-(3-chloro-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-N-ethyl-4-piperazin-1-yl-1,2-dihydropyrazole-3-carboxamide Traditional Name: (5E)-5-(3-chloro-4-hydroxy-6-keto-cyclohexa-2,4-dien-1-ylidene)-N-ethyl-4-piperazino-3-pyrazoline-3-carboxamide Formula: C16H20ClN5O3 MolecularWeight: 365.8147

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=C(C(=C2C=C(C(=CC2=O)O)Cl)NN1)N3CCNCC3

Isomeric SMILES

CCNC(=O)C1=C(/C(=C\2/C=C(C(=CC2=O)O)Cl)/NN1)N3CCNCC3

InChI

InChI=1S/C16H20ClN5O3/c1-2-19-16(25)14-15(22-5-3-18-4-6-22)13(20-21-14)9-7-10(17)12(24)8-11(9)23/h7-8,18,20-21,24H,2-6H2,1H3,(H,19,25)/b13-9+