3-(1H-benzimidazol-2-yl)-8-(dimethylaminomethyl)-6-ethyl-7-oxidanyl-chromen-4-one dihydrochloride

Systemtic Name: 3-(1H-benzimidazol-2-yl)-8-(dimethylaminomethyl)-6-ethyl-7-oxidanyl-chromen-4-one dihydrochloride Openeye Name: 3-(1H-benzimidazol-2-yl)-8-(dimethylaminomethyl)-6-ethyl-7-hydroxy-chromen-4-one dihydrochloride CAS Name: 3-(1H-benzimidazol-2-yl)-8-(dimethylaminomethyl)-6-ethyl-7-hydroxy-1-benzopyran-4-one dihydrochloride IUPAC Name: 3-(1H-benzimidazol-2-yl)-8-(dimethylaminomethyl)-6-ethyl-7-hydroxychromen-4-one dihydrochloride Traditional Name: 3-(1H-benzimidazol-2-yl)-8-(dimethylaminomethyl)-6-ethyl-7-hydroxy-chromone dihydrochloride Formula: C21H23Cl2N3O3 MolecularWeight: 436.33162

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=NC4=CC=CC=C4N3)CN(C)C)O.Cl.Cl

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=NC4=CC=CC=C4N3)CN(C)C)O.Cl.Cl

InChI

InChI=1S/C21H21N3O3.2ClH/c1-4-12-9-13-19(26)15(21-22-16-7-5-6-8-17(16)23-21)11-27-20(13)14(18(12)25)10-24(2)3;;/h5-9,11,25H,4,10H2,1-3H3,(H,22,23);2*1H