4-[(2E)-2-[(5-bromanyl-3-iodanyl-2-propan-2-yloxy-phenyl)methylidene]hydrazinyl]benzoic acid

Systemtic Name: 4-[(2E)-2-[(5-bromanyl-3-iodanyl-2-propan-2-yloxy-phenyl)methylidene]hydrazinyl]benzoic acid Openeye Name: 4-[(2E)-2-[(5-bromo-3-iodo-2-isopropoxy-phenyl)methylene]hydrazino]benzoic acid CAS Name: 4-[(2E)-2-[(5-bromo-3-iodo-2-propan-2-yloxyphenyl)methylidene]hydrazinyl]benzoic acid IUPAC Name: 4-[(2E)-2-[(5-bromo-3-iodo-2-propan-2-yloxyphenyl)methylidene]hydrazinyl]benzoic acid Traditional Name: 4-[(N'E)-N'-(5-bromo-3-iodo-2-isopropoxy-benzylidene)hydrazino]benzoic acid Formula: C17H16BrIN2O3 MolecularWeight: 503.12901

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1C=NNC2=CC=C(C=C2)C(=O)O)Br)I

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1/C=N/NC2=CC=C(C=C2)C(=O)O)Br)I

InChI

InChI=1S/C17H16BrIN2O3/c1-10(2)24-16-12(7-13(18)8-15(16)19)9-20-21-14-5-3-11(4-6-14)17(22)23/h3-10,21H,1-2H3,(H,22,23)/b20-9+