4-[(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C19H16BrN3O3 MolecularWeight: 414.25264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC4=C(C=C3Br)OCO4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC4=C(C=C3Br)OCO4

InChI

InChI=1S/C19H16BrN3O3/c1-12-18(19(24)23(22(12)2)14-6-4-3-5-7-14)21-10-13-8-16-17(9-15(13)20)26-11-25-16/h3-10H,11H2,1-2H3