(E)-N-methyl-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-[(1S)-1-phenylethyl]prop-2-enamide

Systemtic Name: (E)-N-methyl-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-[(1S)-1-phenylethyl]prop-2-enamide Openeye Name: (E)-N-methyl-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-[(1S)-1-phenylethyl]prop-2-enamide CAS Name: (E)-N-methyl-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-[(1S)-1-phenylethyl]-2-propenamide IUPAC Name: (E)-N-methyl-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-[(1S)-1-phenylethyl]prop-2-enamide Traditional Name: (E)-N-methyl-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-[(1S)-1-phenylethyl]acrylamide Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(C)C(=O)C=CC2=CC(=CC3=C2OCOC3)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N(C)C(=O)/C=C/C2=CC(=CC3=C2OCOC3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O5/c1-14(15-6-4-3-5-7-15)21(2)19(23)9-8-16-10-18(22(24)25)11-17-12-26-13-27-20(16)17/h3-11,14H,12-13H2,1-2H3/b9-8+/t14-/m0/s1