[4-bromanyl-2-[(E)-[(2-iodanylphenyl)carbonylhydrazinylidene]methyl]phenyl] 3-methylbenzoate

Systemtic Name: [4-bromanyl-2-[(E)-[(2-iodanylphenyl)carbonylhydrazinylidene]methyl]phenyl] 3-methylbenzoate Openeye Name: [4-bromo-2-[(E)-[(2-iodobenzoyl)hydrazono]methyl]phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [4-bromo-2-[(E)-[[(2-iodophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-[(2-iodobenzoyl)hydrazinylidene]methyl]phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [4-bromo-2-[(E)-[(2-iodobenzoyl)hydrazono]methyl]phenyl] ester Formula: C22H16BrIN2O3 MolecularWeight: 563.18251

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)Br)C=NNC(=O)C3=CC=CC=C3I

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C22H16BrIN2O3/c1-14-5-4-6-15(11-14)22(28)29-20-10-9-17(23)12-16(20)13-25-26-21(27)18-7-2-3-8-19(18)24/h2-13H,1H3,(H,26,27)/b25-13+