1-oxidanylidene-8-(phenylmethyl)-2,4-diaza-8-azoniaspiro[4.5]dec-3-en-3-olate

Systemtic Name: 1-oxidanylidene-8-(phenylmethyl)-2,4-diaza-8-azoniaspiro[4.5]dec-3-en-3-olate Openeye Name: 8-benzyl-1-oxo-2,4-diaza-8-azoniaspiro[4.5]dec-3-en-3-olate CAS Name: 1-oxo-8-(phenylmethyl)-2,4-diaza-8-azoniaspiro[4.5]dec-3-en-3-olate IUPAC Name: 8-benzyl-1-oxo-2,4-diaza-8-azoniaspiro[4.5]dec-3-en-3-olate Traditional Name: 8-benzyl-1-keto-2,4-diaza-8-azoniaspiro[4.5]dec-3-en-3-olate Formula: C14H17N3O2 MolecularWeight: 259.30368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC12C(=O)NC(=N2)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC12C(=O)NC(=N2)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C14H17N3O2/c18-12-14(16-13(19)15-12)6-8-17(9-7-14)10-11-4-2-1-3-5-11/h1-5H,6-10H2,(H2,15,16,18,19)