4-[(3-bromanyl-5-chloranyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 4-[(3-bromanyl-5-chloranyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one Openeye Name: 4-[(3-bromo-5-chloro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one CAS Name: 4-[(3-bromo-5-chloro-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one IUPAC Name: 4-[(3-bromo-5-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one Traditional Name: 4-[(3-bromo-5-chloro-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-2-phenyl-3-pyrazolin-3-one Formula: C17H12BrClN2O2 MolecularWeight: 391.64638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C=C(C(=O)C(=C3)Br)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C=C(C(=O)C(=C3)Br)Cl

InChI

InChI=1S/C17H12BrClN2O2/c1-10-13(7-11-8-14(18)16(22)15(19)9-11)17(23)21(20-10)12-5-3-2-4-6-12/h2-9,20H,1H3