(6-chloranyl-4-ethyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-[(2,4-dimethoxyphenyl)methyl]azanium

Systemtic Name: (6-chloranyl-4-ethyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-[(2,4-dimethoxyphenyl)methyl]azanium Openeye Name: (6-chloro-4-ethyl-7-hydroxy-2-oxo-chromen-8-yl)methyl-[(2,4-dimethoxyphenyl)methyl]ammonium CAS Name: (6-chloro-4-ethyl-7-hydroxy-2-oxo-1-benzopyran-8-yl)methyl-[(2,4-dimethoxyphenyl)methyl]ammonium IUPAC Name: (6-chloro-4-ethyl-7-hydroxy-2-oxochromen-8-yl)methyl-[(2,4-dimethoxyphenyl)methyl]azanium Traditional Name: (6-chloro-4-ethyl-7-hydroxy-2-keto-chromen-8-yl)methyl-(2,4-dimethoxybenzyl)ammonium Formula: C21H23ClNO5+ MolecularWeight: 404.86402

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C(C(=C(C=C12)Cl)O)C[NH2+]CC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCC1=CC(=O)OC2=C(C(=C(C=C12)Cl)O)C[NH2+]CC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H22ClNO5/c1-4-12-7-19(24)28-21-15(12)9-17(22)20(25)16(21)11-23-10-13-5-6-14(26-2)8-18(13)27-3/h5-9,23,25H,4,10-11H2,1-3H3/p+1