(E)-N-(2-bromanyl-4-nitro-phenyl)-3-(3-methoxy-4-phenylmethoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(2-bromanyl-4-nitro-phenyl)-3-(3-methoxy-4-phenylmethoxy-phenyl)prop-2-enamide Openeye Name: (E)-3-(4-benzyloxy-3-methoxy-phenyl)-N-(2-bromo-4-nitro-phenyl)prop-2-enamide CAS Name: (E)-N-(2-bromo-4-nitrophenyl)-3-(3-methoxy-4-phenylmethoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(2-bromo-4-nitrophenyl)-3-(3-methoxy-4-phenylmethoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(4-benzoxy-3-methoxy-phenyl)-N-(2-bromo-4-nitro-phenyl)acrylamide Formula: C23H19BrN2O5 MolecularWeight: 483.31136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)OCC3=CC=CC=C3

InChI

InChI=1S/C23H19BrN2O5/c1-30-22-13-16(7-11-21(22)31-15-17-5-3-2-4-6-17)8-12-23(27)25-20-10-9-18(26(28)29)14-19(20)24/h2-14H,15H2,1H3,(H,25,27)/b12-8+