(4E)-4-[(4-bromophenyl)hydrazinylidene]-5-methyl-2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoyl]pyrazol-3-one

Systemtic Name: (4E)-4-[(4-bromophenyl)hydrazinylidene]-5-methyl-2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoyl]pyrazol-3-one Openeye Name: (4E)-4-[(4-bromophenyl)hydrazono]-5-methyl-2-[2-(4-methyl-2-oxo-chromen-7-yl)oxyacetyl]pyrazol-3-one CAS Name: (4E)-4-[(4-bromophenyl)hydrazinylidene]-5-methyl-2-[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]-3-pyrazolone IUPAC Name: (4E)-4-[(4-bromophenyl)hydrazinylidene]-5-methyl-2-[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]pyrazol-3-one Traditional Name: (4E)-4-[(4-bromophenyl)hydrazono]-2-[2-(2-keto-4-methyl-chromen-7-yl)oxyacetyl]-5-methyl-2-pyrazolin-3-one Formula: C22H17BrN4O5 MolecularWeight: 497.29818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N3C(=O)C(=NNC4=CC=C(C=C4)Br)C(=N3)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N3C(=O)/C(=N/NC4=CC=C(C=C4)Br)/C(=N3)C

InChI

InChI=1S/C22H17BrN4O5/c1-12-9-20(29)32-18-10-16(7-8-17(12)18)31-11-19(28)27-22(30)21(13(2)26-27)25-24-15-5-3-14(23)4-6-15/h3-10,24H,11H2,1-2H3/b25-21+