[(3R)-3-cyano-5-[[3-(ethoxymethyl)-1-benzofuran-2-yl]carbonyloxy]-4-oxidanylidene-pentan-2-ylidene]azanium

Systemtic Name: [(3R)-3-cyano-5-[[3-(ethoxymethyl)-1-benzofuran-2-yl]carbonyloxy]-4-oxidanylidene-pentan-2-ylidene]azanium Openeye Name: [(2R)-2-cyano-4-[3-(ethoxymethyl)benzofuran-2-carbonyl]oxy-1-methyl-3-oxo-butylidene]ammonium CAS Name: [(3R)-3-cyano-5-[[3-(ethoxymethyl)-2-benzofuranyl]-oxomethoxy]-4-oxopentan-2-ylidene]ammonium IUPAC Name: [(3R)-3-cyano-5-[3-(ethoxymethyl)-1-benzofuran-2-carbonyl]oxy-4-oxopentan-2-ylidene]azanium Traditional Name: [(2R)-2-cyano-4-[3-(ethoxymethyl)benzofuran-2-carbonyl]oxy-3-keto-1-methyl-butylidene]ammonium Formula: C18H19N2O5+ MolecularWeight: 343.35386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(OC2=CC=CC=C21)C(=O)OCC(=O)C(C#N)C(=[NH2+])C

Isomeric SMILES

CCOCC1=C(OC2=CC=CC=C21)C(=O)OCC(=O)[C@@H](C#N)C(=[NH2+])C

InChI

InChI=1S/C18H18N2O5/c1-3-23-9-14-12-6-4-5-7-16(12)25-17(14)18(22)24-10-15(21)13(8-19)11(2)20/h4-7,13,20H,3,9-10H2,1-2H3/p+1/t13-/m0/s1