(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate CAS Name: 4-[(2-oxo-1-pyrrolidinyl)methyl]benzoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate Traditional Name: 4-[(2-ketopyrrolidino)methyl]benzoic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C18H19N3O4 MolecularWeight: 341.36116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1=CC=C(C=C1)CN2CCCC2=O

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C1=CC=C(C=C1)CN2CCCC2=O

InChI

InChI=1S/C18H19N3O4/c1-12(20)15(9-19)16(22)11-25-18(24)14-6-4-13(5-7-14)10-21-8-2-3-17(21)23/h4-7,15,20H,2-3,8,10-11H2,1H3