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

Systemtic Name: 4-[(3-bromanyl-4,5-diethoxy-phenyl)methylideneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[(3-bromo-4,5-diethoxy-phenyl)methyleneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[(3-bromo-4,5-diethoxyphenyl)methylideneamino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[(3-bromo-4,5-diethoxyphenyl)methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[(3-bromo-4,5-diethoxy-benzylidene)amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C22H24BrN3O3 MolecularWeight: 458.34826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)Br)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)Br)OCC

InChI

InChI=1S/C22H24BrN3O3/c1-5-28-19-13-16(12-18(23)21(19)29-6-2)14-24-20-15(3)25(4)26(22(20)27)17-10-8-7-9-11-17/h7-14H,5-6H2,1-4H3