[2-methoxy-4-[(E)-[(6-methylpyridin-3-yl)carbonylhydrazinylidene]methyl]phenyl] 4-bromanylbenzoate

Systemtic Name: [2-methoxy-4-[(E)-[(6-methylpyridin-3-yl)carbonylhydrazinylidene]methyl]phenyl] 4-bromanylbenzoate Openeye Name: [2-methoxy-4-[(E)-[(6-methylpyridine-3-carbonyl)hydrazono]methyl]phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-methoxy-4-[(E)-[[(6-methyl-3-pyridinyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-[(6-methylpyridine-3-carbonyl)hydrazinylidene]methyl]phenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-methoxy-4-[(E)-[(6-methylnicotinoyl)hydrazono]methyl]phenyl] ester Formula: C22H18BrN3O4 MolecularWeight: 468.30002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)N/N=C/C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C22H18BrN3O4/c1-14-3-5-17(13-24-14)21(27)26-25-12-15-4-10-19(20(11-15)29-2)30-22(28)16-6-8-18(23)9-7-16/h3-13H,1-2H3,(H,26,27)/b25-12+