5-[(1S,2S)-3-azanylidene-2,4,4-tricyano-1-phenyl-butyl]-2,2-dimethyl-6-oxidanylidene-1,3-dioxin-4-olate

Systemtic Name: 5-[(1S,2S)-3-azanylidene-2,4,4-tricyano-1-phenyl-butyl]-2,2-dimethyl-6-oxidanylidene-1,3-dioxin-4-olate Openeye Name: 2,2-dimethyl-6-oxo-5-[(1S,2S)-2,4,4-tricyano-3-imino-1-phenyl-butyl]-1,3-dioxin-4-olate CAS Name: 2,2-dimethyl-6-oxo-5-[(1S,2S)-2,4,4-tricyano-3-imino-1-phenylbutyl]-1,3-dioxin-4-olate IUPAC Name: 2,2-dimethyl-6-oxo-5-[(1S,2S)-2,4,4-tricyano-3-imino-1-phenylbutyl]-1,3-dioxin-4-olate Traditional Name: 6-keto-2,2-dimethyl-5-[(1S,2S)-2,4,4-tricyano-3-imino-1-phenyl-butyl]-1,3-dioxin-4-olate Formula: C19H15N4O4- MolecularWeight: 363.3468

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=C(C(=O)O1)C(C2=CC=CC=C2)C(C#N)C(=N)C(C#N)C#N)[O-])C

Isomeric SMILES

CC1(OC(=C(C(=O)O1)[C@H](C2=CC=CC=C2)[C@H](C#N)C(=N)C(C#N)C#N)[O-])C

InChI

InChI=1S/C19H16N4O4/c1-19(2)26-17(24)15(18(25)27-19)14(11-6-4-3-5-7-11)13(10-22)16(23)12(8-20)9-21/h3-7,12-14,23-24H,1-2H3/p-1/t13-,14+/m0/s1