(E)-6-[4-[[ethyl(dimethyl)azaniumyl]carbonylamino]-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl]-4-methyl-hex-4-enoate

Systemtic Name: (E)-6-[4-[[ethyl(dimethyl)azaniumyl]carbonylamino]-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl]-4-methyl-hex-4-enoate Openeye Name: (E)-6-[4-[[ethyl(dimethyl)ammonio]carbonylamino]-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl]-4-methyl-hex-4-enoate CAS Name: (E)-6-[4-[[[ethyl(dimethyl)ammonio]-oxomethyl]amino]-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl]-4-methyl-4-hexenoate IUPAC Name: (E)-6-[4-[[ethyl(dimethyl)azaniumyl]carbonylamino]-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl]-4-methylhex-4-enoate Traditional Name: (E)-6-[4-[[ethyl(dimethyl)ammonio]carbonylamino]-3-keto-6-methoxy-7-methyl-phthalan-5-yl]-4-methyl-hex-4-enoate Formula: C22H30N2O6 MolecularWeight: 418.4834

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(C)C(=O)NC1=C(C(=C(C2=C1C(=O)OC2)C)OC)CC=C(C)CCC(=O)[O-]

Isomeric SMILES

CC[N+](C)(C)C(=O)NC1=C(C(=C(C2=C1C(=O)OC2)C)OC)C/C=C(\C)/CCC(=O)[O-]

InChI

InChI=1S/C22H30N2O6/c1-7-24(4,5)22(28)23-19-15(10-8-13(2)9-11-17(25)26)20(29-6)14(3)16-12-30-21(27)18(16)19/h8H,7,9-12H2,1-6H3,(H-,23,25,26,27,28)/b13-8+