(E)-N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-(3-nitrophenyl)acrylamide Formula: C18H15ClN2O5 MolecularWeight: 374.7751

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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-])Cl)OC1

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClN2O5/c19-14-10-16-17(26-8-2-7-25-16)11-15(14)20-18(22)6-5-12-3-1-4-13(9-12)21(23)24/h1,3-6,9-11H,2,7-8H2,(H,20,22)/b6-5+