(4-dimethylaminophenyl)methyl-ethyl-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-ethyl-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-ethyl-[(7-hydroxy-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-ethyl-[(7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-ethyl-[(7-hydroxy-2-oxochromen-4-yl)methyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-ethyl-[(7-hydroxy-2-keto-chromen-4-yl)methyl]ammonium Formula: C21H25N2O3+ MolecularWeight: 353.4348

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(C=C1)N(C)C)CC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

CC[NH+](CC1=CC=C(C=C1)N(C)C)CC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C21H24N2O3/c1-4-23(13-15-5-7-17(8-6-15)22(2)3)14-16-11-21(25)26-20-12-18(24)9-10-19(16)20/h5-12,24H,4,13-14H2,1-3H3/p+1