(E)-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: (E)-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-cyclopropyl-3-(6-nitro-1,3-benzodioxol-5-yl)-N-p-anisyl-acrylamide Formula: C21H20N2O6 MolecularWeight: 396.3933

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(C2CC2)C(=O)C=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

COC1=CC=C(C=C1)CN(C2CC2)C(=O)/C=C/C3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C21H20N2O6/c1-27-17-7-2-14(3-8-17)12-22(16-5-6-16)21(24)9-4-15-10-19-20(29-13-28-19)11-18(15)23(25)26/h2-4,7-11,16H,5-6,12-13H2,1H3/b9-4+