(6Z)-4-bromanyl-6-(2-methyl-4-piperazin-1-yl-1H-pyrazol-5-ylidene)-3-oxidanyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-4-bromanyl-6-(2-methyl-4-piperazin-1-yl-1H-pyrazol-5-ylidene)-3-oxidanyl-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-4-bromo-3-hydroxy-6-(2-methyl-4-piperazin-1-yl-1H-pyrazol-5-ylidene)cyclohexa-2,4-dien-1-one CAS Name: (6Z)-4-bromo-3-hydroxy-6-[2-methyl-4-(1-piperazinyl)-1H-pyrazol-5-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-4-bromo-3-hydroxy-6-(2-methyl-4-piperazin-1-yl-1H-pyrazol-5-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-4-bromo-3-hydroxy-6-(1-methyl-4-piperazino-3-pyrazolin-3-ylidene)cyclohexa-2,4-dien-1-one Formula: C14H17BrN4O2 MolecularWeight: 353.21438

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=C2C=C(C(=CC2=O)O)Br)N1)N3CCNCC3

Isomeric SMILES

CN1C=C(/C(=C/2\C=C(C(=CC2=O)O)Br)/N1)N3CCNCC3

InChI

InChI=1S/C14H17BrN4O2/c1-18-8-11(19-4-2-16-3-5-19)14(17-18)9-6-10(15)13(21)7-12(9)20/h6-8,16-17,21H,2-5H2,1H3/b14-9-