(Z)-4-[(4-bromanyl-5-phenyl-1H-pyrazol-3-yl)amino]-4-oxidanyl-but-3-en-2-one

Systemtic Name: (Z)-4-[(4-bromanyl-5-phenyl-1H-pyrazol-3-yl)amino]-4-oxidanyl-but-3-en-2-one Openeye Name: (Z)-4-[(4-bromo-5-phenyl-1H-pyrazol-3-yl)amino]-4-hydroxy-but-3-en-2-one CAS Name: (Z)-4-[(4-bromo-5-phenyl-1H-pyrazol-3-yl)amino]-4-hydroxy-3-buten-2-one IUPAC Name: (Z)-4-[(4-bromo-5-phenyl-1H-pyrazol-3-yl)amino]-4-hydroxybut-3-en-2-one Traditional Name: (Z)-4-[(4-bromo-5-phenyl-1H-pyrazol-3-yl)amino]-4-hydroxy-but-3-en-2-one Formula: C13H12BrN3O2 MolecularWeight: 322.15728

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=C(NC1=NNC(=C1Br)C2=CC=CC=C2)O

Isomeric SMILES

CC(=O)/C=C(/NC1=NNC(=C1Br)C2=CC=CC=C2)\O

InChI

InChI=1S/C13H12BrN3O2/c1-8(18)7-10(19)15-13-11(14)12(16-17-13)9-5-3-2-4-6-9/h2-7,19H,1H3,(H2,15,16,17)/b10-7-