(E)-3-(5-bromanyl-2-methoxy-phenyl)-N-[4-(4-nitrophenyl)sulfanylphenyl]prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-N-[4-(4-nitrophenyl)sulfanylphenyl]prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-[4-(4-nitrophenyl)sulfanylphenyl]prop-2-enamide CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-[4-[(4-nitrophenyl)thio]phenyl]-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-[4-(4-nitrophenyl)sulfanylphenyl]prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-[4-[(4-nitrophenyl)thio]phenyl]acrylamide Formula: C22H17BrN2O4S MolecularWeight: 485.35038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C/C(=O)NC2=CC=C(C=C2)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H17BrN2O4S/c1-29-21-12-3-16(23)14-15(21)2-13-22(26)24-17-4-8-19(9-5-17)30-20-10-6-18(7-11-20)25(27)28/h2-14H,1H3,(H,24,26)/b13-2+