(E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-phenethyl-N-(thiophen-2-ylmethyl)prop-2-enamide

Systemtic Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-phenethyl-N-(thiophen-2-ylmethyl)prop-2-enamide Openeye Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-phenethyl-N-(2-thienylmethyl)prop-2-enamide CAS Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-phenethyl-N-(thiophen-2-ylmethyl)-2-propenamide IUPAC Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-phenethyl-N-(thiophen-2-ylmethyl)prop-2-enamide Traditional Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-phenethyl-N-(2-thenyl)acrylamide Formula: C24H22N2O5S MolecularWeight: 450.50688

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC(=C2)[N+](=O)[O-])C=CC(=O)N(CCC3=CC=CC=C3)CC4=CC=CS4)OCO1

Isomeric SMILES

C1C2=C(C(=CC(=C2)[N+](=O)[O-])/C=C/C(=O)N(CCC3=CC=CC=C3)CC4=CC=CS4)OCO1

InChI

InChI=1S/C24H22N2O5S/c27-23(9-8-19-13-21(26(28)29)14-20-16-30-17-31-24(19)20)25(15-22-7-4-12-32-22)11-10-18-5-2-1-3-6-18/h1-9,12-14H,10-11,15-17H2/b9-8+