3-[1-(4-chlorophenyl)-3,3-dimethyl-2-benzofuran-1-yl]-N-methyl-propan-1-amine hydrochloride

Systemtic Name: 3-[1-(4-chlorophenyl)-3,3-dimethyl-2-benzofuran-1-yl]-N-methyl-propan-1-amine hydrochloride Openeye Name: 3-[1-(4-chlorophenyl)-3,3-dimethyl-isobenzofuran-1-yl]-N-methyl-propan-1-amine hydrochloride CAS Name: 3-[1-(4-chlorophenyl)-3,3-dimethyl-1-isobenzofuranyl]-N-methyl-1-propanamine hydrochloride IUPAC Name: 3-[1-(4-chlorophenyl)-3,3-dimethyl-2-benzofuran-1-yl]-N-methylpropan-1-amine hydrochloride Traditional Name: 3-[1-(4-chlorophenyl)-3,3-dimethyl-phthalan-1-yl]propyl-methyl-amine hydrochloride Formula: C20H25Cl2NO MolecularWeight: 366.3246

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2C(O1)(CCCNC)C3=CC=C(C=C3)Cl)C.Cl

Isomeric SMILES

CC1(C2=CC=CC=C2C(O1)(CCCNC)C3=CC=C(C=C3)Cl)C.Cl

InChI

InChI=1S/C20H24ClNO.ClH/c1-19(2)17-7-4-5-8-18(17)20(23-19,13-6-14-22-3)15-9-11-16(21)12-10-15;/h4-5,7-12,22H,6,13-14H2,1-3H3;1H