(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-[(3,5-dimethoxyphenyl)carbonylamino]ethanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-[(3,5-dimethoxyphenyl)carbonylamino]ethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-[(3,5-dimethoxybenzoyl)amino]acetate CAS Name: 2-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]acetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-[(3,5-dimethoxybenzoyl)amino]acetate Traditional Name: 2-[(3,5-dimethoxybenzoyl)amino]acetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C17H19N3O6 MolecularWeight: 361.34926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O6/c1-10(19)14(7-18)15(21)9-26-16(22)8-20-17(23)11-4-12(24-2)6-13(5-11)25-3/h4-6,14,19H,8-9H2,1-3H3,(H,20,23)