N-cyano-N'-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-1-oxidanidyl-pyridin-1-ium-3-carboximidamide

Systemtic Name: N-cyano-N'-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-1-oxidanidyl-pyridin-1-ium-3-carboximidamide Openeye Name: N-cyano-N'-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-1-oxido-pyridin-1-ium-3-carboxamidine CAS Name: N-cyano-N'-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-1-oxido-3-pyridin-1-iumcarboximidamide IUPAC Name: N-cyano-N'-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-1-oxidopyridin-1-ium-3-carboximidamide Traditional Name: N-cyano-N'-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-1-oxido-pyridin-1-ium-3-carboxamidine Formula: C19H17N5O3 MolecularWeight: 363.36998

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N=C(C3=C[N+](=CC=C3)[O-])NC#N)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N=C(C3=C[N+](=CC=C3)[O-])NC#N)O)C

InChI

InChI=1S/C19H17N5O3/c1-19(2)17(25)16(14-8-12(9-20)5-6-15(14)27-19)23-18(22-11-21)13-4-3-7-24(26)10-13/h3-8,10,16-17,25H,1-2H3,(H,22,23)