2-methyl-N-[2-[[(E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enoyl]amino]ethyl]propanamide

Systemtic Name: 2-methyl-N-[2-[[(E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enoyl]amino]ethyl]propanamide Openeye Name: 2-methyl-N-[2-[[(E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enoyl]amino]ethyl]propanamide CAS Name: 2-methyl-N-[2-[[(E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-1-oxoprop-2-enyl]amino]ethyl]propanamide IUPAC Name: 2-methyl-N-[2-[[(E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enoyl]amino]ethyl]propanamide Traditional Name: 2-methyl-N-[2-[[(E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)acryloyl]amino]ethyl]propionamide Formula: C17H21N3O6 MolecularWeight: 363.36514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C=CC1=CC(=CC2=C1OCOC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)/C=C/C1=CC(=CC2=C1OCOC2)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O6/c1-11(2)17(22)19-6-5-18-15(21)4-3-12-7-14(20(23)24)8-13-9-25-10-26-16(12)13/h3-4,7-8,11H,5-6,9-10H2,1-2H3,(H,18,21)(H,19,22)/b4-3+