(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2,3,4-trimethoxybenzoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2,3,4-trimethoxybenzoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2,3,4-trimethoxybenzoate CAS Name: 2,3,4-trimethoxybenzoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2,3,4-trimethoxybenzoate Traditional Name: 2,3,4-trimethoxybenzoic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C16H18N2O6 MolecularWeight: 334.32392

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1=C(C(=C(C=C1)OC)OC)OC

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C1=C(C(=C(C=C1)OC)OC)OC

InChI

InChI=1S/C16H18N2O6/c1-9(18)11(7-17)12(19)8-24-16(20)10-5-6-13(21-2)15(23-4)14(10)22-3/h5-6,11,18H,8H2,1-4H3