[6-ethyl-3-(4-nitrophenyl)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-dimethyl-azanium

Systemtic Name: [6-ethyl-3-(4-nitrophenyl)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-dimethyl-azanium Openeye Name: [6-ethyl-7-hydroxy-3-(4-nitrophenyl)-4-oxo-chromen-8-yl]methyl-dimethyl-ammonium CAS Name: [6-ethyl-7-hydroxy-3-(4-nitrophenyl)-4-oxo-1-benzopyran-8-yl]methyl-dimethylammonium IUPAC Name: [6-ethyl-7-hydroxy-3-(4-nitrophenyl)-4-oxochromen-8-yl]methyl-dimethylazanium Traditional Name: [6-ethyl-7-hydroxy-4-keto-3-(4-nitrophenyl)chromen-8-yl]methyl-dimethyl-ammonium Formula: C20H21N2O5+ MolecularWeight: 369.39114

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=CC=C(C=C3)[N+](=O)[O-])C[NH+](C)C)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=CC=C(C=C3)[N+](=O)[O-])C[NH+](C)C)O

InChI

InChI=1S/C20H20N2O5/c1-4-12-9-15-19(24)17(13-5-7-14(8-6-13)22(25)26)11-27-20(15)16(18(12)23)10-21(2)3/h5-9,11,23H,4,10H2,1-3H3/p+1