(E)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(2-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(2-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(2-nitrophenyl)prop-2-enamide CAS Name: (E)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(2-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(2-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(2-nitrophenyl)acrylamide Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)C=CC3=CC=CC=C3[N+](=O)[O-])OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)/C=C/C3=CC=CC=C3[N+](=O)[O-])OC1

InChI

InChI=1S/C18H16N2O5/c21-18(9-6-13-4-1-2-5-15(13)20(22)23)19-14-7-8-16-17(12-14)25-11-3-10-24-16/h1-2,4-9,12H,3,10-11H2,(H,19,21)/b9-6+