1-[3-(dimethylamino)propyl]-1-(4-methoxyphenyl)-3H-2-benzofuran-5-carbonitrile hydrochloride

Systemtic Name: 1-[3-(dimethylamino)propyl]-1-(4-methoxyphenyl)-3H-2-benzofuran-5-carbonitrile hydrochloride Openeye Name: 1-[3-(dimethylamino)propyl]-1-(4-methoxyphenyl)-3H-isobenzofuran-5-carbonitrile hydrochloride CAS Name: 1-[3-(dimethylamino)propyl]-1-(4-methoxyphenyl)-3H-isobenzofuran-5-carbonitrile hydrochloride IUPAC Name: 1-[3-(dimethylamino)propyl]-1-(4-methoxyphenyl)-3H-2-benzofuran-5-carbonitrile hydrochloride Traditional Name: 1-[3-(dimethylamino)propyl]-1-(4-methoxyphenyl)phthalan-5-carbonitrile hydrochloride Formula: C21H25ClN2O2 MolecularWeight: 372.8884

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCC1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)OC.Cl

Isomeric SMILES

CN(C)CCCC1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)OC.Cl

InChI

InChI=1S/C21H24N2O2.ClH/c1-23(2)12-4-11-21(18-6-8-19(24-3)9-7-18)20-10-5-16(14-22)13-17(20)15-25-21;/h5-10,13H,4,11-12,15H2,1-3H3;1H