(2S,5R)-2-methyl-8-(4-methylphenyl)imino-4-oxidanylidene-3-oxa-9-thia-7-azaspiro[4.4]non-6-en-6-olate

Systemtic Name: (2S,5R)-2-methyl-8-(4-methylphenyl)imino-4-oxidanylidene-3-oxa-9-thia-7-azaspiro[4.4]non-6-en-6-olate Openeye Name: (2S,5R)-2-methyl-4-oxo-8-(p-tolylimino)-3-oxa-9-thia-7-azaspiro[4.4]non-6-en-6-olate CAS Name: (2S,5R)-2-methyl-8-(4-methylphenyl)imino-4-oxo-3-oxa-9-thia-7-azaspiro[4.4]non-6-en-6-olate IUPAC Name: (2S,5R)-2-methyl-8-(4-methylphenyl)imino-4-oxo-3-oxa-9-thia-7-azaspiro[4.4]non-6-en-6-olate Traditional Name: (2S,5R)-4-keto-2-methyl-8-(p-tolylimino)-3-oxa-9-thia-7-azaspiro[4.4]non-6-en-6-olate Formula: C14H13N2O3S- MolecularWeight: 289.32962

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2(C(=NC(=NC3=CC=C(C=C3)C)S2)[O-])C(=O)O1

Isomeric SMILES

C[C@H]1C[C@@]2(C(=NC(=NC3=CC=C(C=C3)C)S2)[O-])C(=O)O1

InChI

InChI=1S/C14H14N2O3S/c1-8-3-5-10(6-4-8)15-13-16-11(17)14(20-13)7-9(2)19-12(14)18/h3-6,9H,7H2,1-2H3,(H,15,16,17)/p-1/t9-,14+/m0/s1