(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 3-methoxybenzoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 3-methoxybenzoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O4/c1-9(16)12(7-15)13(17)8-20-14(18)10-4-3-5-11(6-10)19-2/h3-6,12,16H,8H2,1-2H3