(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(2-hydroxyethylamino)benzoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(2-hydroxyethylamino)benzoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-(2-hydroxyethylamino)benzoate CAS Name: 2-(2-hydroxyethylamino)benzoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-(2-hydroxyethylamino)benzoate Traditional Name: 2-(2-hydroxyethylamino)benzoic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1=CC=CC=C1NCCO

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C1=CC=CC=C1NCCO

InChI

InChI=1S/C15H17N3O4/c1-10(17)12(8-16)14(20)9-22-15(21)11-4-2-3-5-13(11)18-6-7-19/h2-5,12,17-19H,6-7,9H2,1H3