(E)-N-[4-(2-methoxyphenoxy)phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: (E)-N-[4-(2-methoxyphenoxy)phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-N-[4-(2-methoxyphenoxy)phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-N-[4-(2-methoxyphenoxy)phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-N-[4-(2-methoxyphenoxy)phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-[4-(2-methoxyphenoxy)phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C23H18N2O7 MolecularWeight: 434.39822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=CC=C(C=C2)NC(=O)C=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

COC1=CC=CC=C1OC2=CC=C(C=C2)NC(=O)/C=C/C3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C23H18N2O7/c1-29-19-4-2-3-5-20(19)32-17-9-7-16(8-10-17)24-23(26)11-6-15-12-21-22(31-14-30-21)13-18(15)25(27)28/h2-13H,14H2,1H3,(H,24,26)/b11-6+