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

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

Systemtic Name:(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 4-(hydroxymethyl)benzoate
Openeye Name:(3-cyano-4-imino-2-oxo-pentyl) 4-(hydroxymethyl)benzoate
CAS Name:4-(hydroxymethyl)benzoic acid (3-cyano-4-imino-2-oxopentyl) ester
IUPAC Name:(3-cyano-4-imino-2-oxopentyl) 4-(hydroxymethyl)benzoate
Traditional Name:4-methylolbenzoic 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=C(C=C1)CO


Isomeric SMILES

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


InChI

InChI=1S/C14H14N2O4/c1-9(16)12(6-15)13(18)8-20-14(19)11-4-2-10(7-17)3-5-11/h2-5,12,16-17H,7-8H2,1H3


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