[(3R)-3-cyano-5-[(5-methoxy-3-methyl-1-benzofuran-2-yl)carbonyloxy]-4-oxidanylidene-pent-1-en-2-yl]azanium

Systemtic Name: [(3R)-3-cyano-5-[(5-methoxy-3-methyl-1-benzofuran-2-yl)carbonyloxy]-4-oxidanylidene-pent-1-en-2-yl]azanium Openeye Name: [(2R)-2-cyano-4-(5-methoxy-3-methyl-benzofuran-2-carbonyl)oxy-1-methylene-3-oxo-butyl]ammonium CAS Name: [(3R)-3-cyano-5-[(5-methoxy-3-methyl-2-benzofuranyl)-oxomethoxy]-4-oxopent-1-en-2-yl]ammonium IUPAC Name: [(3R)-3-cyano-5-(5-methoxy-3-methyl-1-benzofuran-2-carbonyl)oxy-4-oxopent-1-en-2-yl]azanium Traditional Name: 1-[(1R)-1-cyano-2-keto-3-(5-methoxy-3-methyl-benzofuran-2-carbonyl)oxy-propyl]vinylammonium Formula: C17H17N2O5+ MolecularWeight: 329.32728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)OCC(=O)C(C#N)C(=C)[NH3+]

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)OCC(=O)[C@@H](C#N)C(=C)[NH3+]

InChI

InChI=1S/C17H16N2O5/c1-9-12-6-11(22-3)4-5-15(12)24-16(9)17(21)23-8-14(20)13(7-18)10(2)19/h4-6,13H,2,8,19H2,1,3H3/p+1/t13-/m0/s1