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

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 4-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 4-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 4-(2-oxo-1-pyrrolidinyl)benzoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 4-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 4-(2-ketopyrrolidino)benzoic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1=CC=C(C=C1)N2CCCC2=O

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C1=CC=C(C=C1)N2CCCC2=O

InChI

InChI=1S/C17H17N3O4/c1-11(19)14(9-18)15(21)10-24-17(23)12-4-6-13(7-5-12)20-8-2-3-16(20)22/h4-7,14,19H,2-3,8,10H2,1H3