(phenylmethyl) 2-(methylideneamino)-6-oxidanylidene-hexanoate

Systemtic Name: (phenylmethyl) 2-(methylideneamino)-6-oxidanylidene-hexanoate Openeye Name: benzyl 2-(methyleneamino)-6-oxo-hexanoate CAS Name: 2-(methyleneamino)-6-oxohexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(methylideneamino)-6-oxohexanoate Traditional Name: 6-keto-2-(methyleneamino)hexanoic acid benzyl ester Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

C=NC(CCCC=O)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

C=NC(CCCC=O)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C14H17NO3/c1-15-13(9-5-6-10-16)14(17)18-11-12-7-3-2-4-8-12/h2-4,7-8,10,13H,1,5-6,9,11H2