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

Systemtic Name: (E)-N-[2-(4-ethoxyphenoxy)phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-N-[2-(4-ethoxyphenoxy)phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-N-[2-(4-ethoxyphenoxy)phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-N-[2-(4-ethoxyphenoxy)phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-[2-(4-ethoxyphenoxy)phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C24H20N2O7 MolecularWeight: 448.4248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)C=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)/C=C/C3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C24H20N2O7/c1-2-30-17-8-10-18(11-9-17)33-21-6-4-3-5-19(21)25-24(27)12-7-16-13-22-23(32-15-31-22)14-20(16)26(28)29/h3-14H,2,15H2,1H3,(H,25,27)/b12-7+