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

Systemtic Name: (E)-N-[(1R)-2-methyl-1-thiophen-2-yl-propyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Openeye Name: (E)-N-[(1R)-2-methyl-1-(2-thienyl)propyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide CAS Name: (E)-N-[(1R)-2-methyl-1-thiophen-2-ylpropyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-2-propenamide IUPAC Name: (E)-N-[(1R)-2-methyl-1-thiophen-2-ylpropyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Traditional Name: (E)-N-[(1R)-2-methyl-1-(2-thienyl)propyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)acrylamide Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)NC(=O)C=CC2=CC(=CC3=C2OCOC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@H](C1=CC=CS1)NC(=O)/C=C/C2=CC(=CC3=C2OCOC3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O5S/c1-12(2)18(16-4-3-7-27-16)20-17(22)6-5-13-8-15(21(23)24)9-14-10-25-11-26-19(13)14/h3-9,12,18H,10-11H2,1-2H3,(H,20,22)/b6-5+/t18-/m1/s1