(E)-N-(2-bromanyl-4-nitro-phenyl)-2-cyano-3-[3-ethoxy-5-iodanyl-4-[(2-methylphenyl)methoxy]phenyl]prop-2-enamide

Systemtic Name: (E)-N-(2-bromanyl-4-nitro-phenyl)-2-cyano-3-[3-ethoxy-5-iodanyl-4-[(2-methylphenyl)methoxy]phenyl]prop-2-enamide Openeye Name: (E)-N-(2-bromo-4-nitro-phenyl)-2-cyano-3-[3-ethoxy-5-iodo-4-(o-tolylmethoxy)phenyl]prop-2-enamide CAS Name: (E)-N-(2-bromo-4-nitrophenyl)-2-cyano-3-[3-ethoxy-5-iodo-4-[(2-methylphenyl)methoxy]phenyl]-2-propenamide IUPAC Name: (E)-N-(2-bromo-4-nitrophenyl)-2-cyano-3-[3-ethoxy-5-iodo-4-[(2-methylphenyl)methoxy]phenyl]prop-2-enamide Traditional Name: (E)-N-(2-bromo-4-nitro-phenyl)-2-cyano-3-[3-ethoxy-5-iodo-4-(2-methylbenzyl)oxy-phenyl]acrylamide Formula: C26H21BrIN3O5 MolecularWeight: 662.27051

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)I)OCC3=CC=CC=C3C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)I)OCC3=CC=CC=C3C

InChI

InChI=1S/C26H21BrIN3O5/c1-3-35-24-12-17(11-22(28)25(24)36-15-18-7-5-4-6-16(18)2)10-19(14-29)26(32)30-23-9-8-20(31(33)34)13-21(23)27/h4-13H,3,15H2,1-2H3,(H,30,32)/b19-10+