(phenylmethyl) (4E)-4-(1,3-dithian-2-yl)-4-hydroxyimino-butanoate

Systemtic Name: (phenylmethyl) (4E)-4-(1,3-dithian-2-yl)-4-hydroxyimino-butanoate Openeye Name: benzyl (4E)-4-(1,3-dithian-2-yl)-4-hydroxyimino-butanoate CAS Name: (4E)-4-(1,3-dithian-2-yl)-4-hydroxyiminobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl (4E)-4-(1,3-dithian-2-yl)-4-hydroxyiminobutanoate Traditional Name: (4E)-4-(1,3-dithian-2-yl)-4-hydroximino-butyric acid benzyl ester Formula: C15H19NO3S2 MolecularWeight: 325.44626

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C(=NO)CCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CSC(SC1)/C(=N/O)/CCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C15H19NO3S2/c17-14(19-11-12-5-2-1-3-6-12)8-7-13(16-18)15-20-9-4-10-21-15/h1-3,5-6,15,18H,4,7-11H2/b16-13+