(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(furan-2-ylcarbonylamino)-4,5-dimethoxy-benzoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(furan-2-ylcarbonylamino)-4,5-dimethoxy-benzoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-(furan-2-carbonylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]-4,5-dimethoxybenzoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-(furan-2-carbonylamino)-4,5-dimethoxybenzoate Traditional Name: 2-(2-furoylamino)-4,5-dimethoxy-benzoic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C20H19N3O7 MolecularWeight: 413.38076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1=CC(=C(C=C1NC(=O)C2=CC=CO2)OC)OC

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C1=CC(=C(C=C1NC(=O)C2=CC=CO2)OC)OC

InChI

InChI=1S/C20H19N3O7/c1-11(22)13(9-21)15(24)10-30-20(26)12-7-17(27-2)18(28-3)8-14(12)23-19(25)16-5-4-6-29-16/h4-8,13,22H,10H2,1-3H3,(H,23,25)