(Z)-N,N-diethyl-3-(2-methyl-5-nitro-1-benzofuran-3-yl)but-2-enamide

Systemtic Name: (Z)-N,N-diethyl-3-(2-methyl-5-nitro-1-benzofuran-3-yl)but-2-enamide Openeye Name: (Z)-N,N-diethyl-3-(2-methyl-5-nitro-benzofuran-3-yl)but-2-enamide CAS Name: (Z)-N,N-diethyl-3-(2-methyl-5-nitro-3-benzofuranyl)-2-butenamide IUPAC Name: (Z)-N,N-diethyl-3-(2-methyl-5-nitro-1-benzofuran-3-yl)but-2-enamide Traditional Name: (Z)-N,N-diethyl-3-(2-methyl-5-nitro-benzofuran-3-yl)but-2-enamide Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C=C(C)C1=C(OC2=C1C=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)C(=O)/C=C(/C)\C1=C(OC2=C1C=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C17H20N2O4/c1-5-18(6-2)16(20)9-11(3)17-12(4)23-15-8-7-13(19(21)22)10-14(15)17/h7-10H,5-6H2,1-4H3/b11-9-