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

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 3-(3,5-dimethoxyphenyl)propanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 3-(3,5-dimethoxyphenyl)propanoate CAS Name: 3-(3,5-dimethoxyphenyl)propanoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 3-(3,5-dimethoxyphenyl)propanoate Traditional Name: 3-(3,5-dimethoxyphenyl)propionic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C17H20N2O5 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O5/c1-11(19)15(9-18)16(20)10-24-17(21)5-4-12-6-13(22-2)8-14(7-12)23-3/h6-8,15,19H,4-5,10H2,1-3H3