4-[[(E)-(3-bromanyl-5-iodanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[(E)-(3-bromanyl-5-iodanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[(E)-(3-bromo-5-iodo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[(E)-(3-bromo-5-iodo-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[(E)-(3-bromo-5-iodo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[(E)-(3-bromo-5-iodo-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C18H15BrIN3O2 MolecularWeight: 512.13907

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC=C3C=C(C=C(C3=O)I)Br

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N/C=C/3\C=C(C=C(C3=O)I)Br

InChI

InChI=1S/C18H15BrIN3O2/c1-11-16(21-10-12-8-13(19)9-15(20)17(12)24)18(25)23(22(11)2)14-6-4-3-5-7-14/h3-10,21H,1-2H3/b12-10+