(E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(2,4,6-trimethylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(2,4,6-trimethylphenyl)prop-2-enamide Openeye Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(2,4,6-trimethylphenyl)prop-2-enamide CAS Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(2,4,6-trimethylphenyl)-2-propenamide IUPAC Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(2,4,6-trimethylphenyl)prop-2-enamide Traditional Name: (E)-N-mesityl-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)/C=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C

InChI

InChI=1S/C19H18N2O5/c1-11-6-12(2)19(13(3)7-11)20-18(22)5-4-14-8-16-17(26-10-25-16)9-15(14)21(23)24/h4-9H,10H2,1-3H3,(H,20,22)/b5-4+