(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(3,4,5-trimethoxyphenyl)propanoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(3,4,5-trimethoxyphenyl)propionic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C18H22N2O6 MolecularWeight: 362.37708

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)CCC1=CC(=C(C(=C1)OC)OC)OC

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)CCC1=CC(=C(C(=C1)OC)OC)OC

InChI

InChI=1S/C18H22N2O6/c1-11(20)13(9-19)14(21)10-26-17(22)6-5-12-7-15(23-2)18(25-4)16(8-12)24-3/h7-8,13,20H,5-6,10H2,1-4H3