ethyl 2-azanyl-7,7-dimethyl-4-(1-methylpyridin-1-ium-3-yl)-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-7,7-dimethyl-4-(1-methylpyridin-1-ium-3-yl)-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate Openeye Name: ethyl 2-amino-7,7-dimethyl-4-(1-methylpyridin-1-ium-3-yl)-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate CAS Name: 2-amino-7,7-dimethyl-4-(1-methyl-3-pyridin-1-iumyl)-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-7,7-dimethyl-4-(1-methylpyridin-1-ium-3-yl)-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate Traditional Name: 2-amino-5-keto-7,7-dimethyl-4-(1-methylpyridin-1-ium-3-yl)-6,8-dihydro-4H-chromene-3-carboxylic acid ethyl ester Formula: C20H25N2O4+ MolecularWeight: 357.4235

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C3=C[N+](=CC=C3)C)C(=O)CC(C2)(C)C)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C1C3=C[N+](=CC=C3)C)C(=O)CC(C2)(C)C)N

InChI

InChI=1S/C20H24N2O4/c1-5-25-19(24)17-15(12-7-6-8-22(4)11-12)16-13(23)9-20(2,3)10-14(16)26-18(17)21/h6-8,11,15H,5,9-10H2,1-4H3,(H-,21,24)/p+1