1-benzofuran-2-yl-[4-(dimethylaminomethyl)-2-methyl-5-oxidanyl-1-benzofuran-3-yl]methanone hydrate hydrochloride

Systemtic Name: 1-benzofuran-2-yl-[4-(dimethylaminomethyl)-2-methyl-5-oxidanyl-1-benzofuran-3-yl]methanone hydrate hydrochloride Openeye Name: benzofuran-2-yl-[4-(dimethylaminomethyl)-5-hydroxy-2-methyl-benzofuran-3-yl]methanone hydrate hydrochloride CAS Name: 2-benzofuranyl-[4-(dimethylaminomethyl)-5-hydroxy-2-methyl-3-benzofuranyl]methanone hydrate hydrochloride IUPAC Name: 1-benzofuran-2-yl-[4-(dimethylaminomethyl)-5-hydroxy-2-methyl-1-benzofuran-3-yl]methanone hydrate hydrochloride Traditional Name: benzofuran-2-yl-[4-(dimethylaminomethyl)-5-hydroxy-2-methyl-benzofuran-3-yl]methanone hydrate hydrochloride Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2CN(C)C)O)C(=O)C3=CC4=CC=CC=C4O3.O.Cl

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2CN(C)C)O)C(=O)C3=CC4=CC=CC=C4O3.O.Cl

InChI

InChI=1S/C21H19NO4.ClH.H2O/c1-12-19(21(24)18-10-13-6-4-5-7-16(13)26-18)20-14(11-22(2)3)15(23)8-9-17(20)25-12;;/h4-10,23H,11H2,1-3H3;1H;1H2