[4-(6-chloranyl-2-oxidanylidene-chromen-3-yl)-7-oxidanyl-2-oxidanylidene-chromen-8-yl]methyl-dimethyl-azanium

Systemtic Name: [4-(6-chloranyl-2-oxidanylidene-chromen-3-yl)-7-oxidanyl-2-oxidanylidene-chromen-8-yl]methyl-dimethyl-azanium Openeye Name: [4-(6-chloro-2-oxo-chromen-3-yl)-7-hydroxy-2-oxo-chromen-8-yl]methyl-dimethyl-ammonium CAS Name: [4-(6-chloro-2-oxo-1-benzopyran-3-yl)-7-hydroxy-2-oxo-1-benzopyran-8-yl]methyl-dimethylammonium IUPAC Name: [4-(6-chloro-2-oxochromen-3-yl)-7-hydroxy-2-oxochromen-8-yl]methyl-dimethylazanium Traditional Name: [4-(6-chloro-2-keto-chromen-3-yl)-7-hydroxy-2-keto-chromen-8-yl]methyl-dimethyl-ammonium Formula: C21H17ClNO5+ MolecularWeight: 398.81638

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=C(C=CC2=C1OC(=O)C=C2C3=CC4=C(C=CC(=C4)Cl)OC3=O)O

Isomeric SMILES

C[NH+](C)CC1=C(C=CC2=C1OC(=O)C=C2C3=CC4=C(C=CC(=C4)Cl)OC3=O)O

InChI

InChI=1S/C21H16ClNO5/c1-23(2)10-16-17(24)5-4-13-14(9-19(25)28-20(13)16)15-8-11-7-12(22)3-6-18(11)27-21(15)26/h3-9,24H,10H2,1-2H3/p+1