1-[1-(4-chlorophenyl)-1-[3-(dimethylamino)propyl]-3H-2-benzofuran-5-yl]propan-1-one

Systemtic Name: 1-[1-(4-chlorophenyl)-1-[3-(dimethylamino)propyl]-3H-2-benzofuran-5-yl]propan-1-one Openeye Name: 1-[1-(4-chlorophenyl)-1-[3-(dimethylamino)propyl]-3H-isobenzofuran-5-yl]propan-1-one CAS Name: 1-[1-(4-chlorophenyl)-1-[3-(dimethylamino)propyl]-3H-isobenzofuran-5-yl]-1-propanone IUPAC Name: 1-[1-(4-chlorophenyl)-1-[3-(dimethylamino)propyl]-3H-2-benzofuran-5-yl]propan-1-one Traditional Name: 1-[1-(4-chlorophenyl)-1-[3-(dimethylamino)propyl]phthalan-5-yl]propan-1-one Formula: C22H26ClNO2 MolecularWeight: 371.90034

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC2=C(C=C1)C(OC2)(CCCN(C)C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCC(=O)C1=CC2=C(C=C1)C(OC2)(CCCN(C)C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H26ClNO2/c1-4-21(25)16-6-11-20-17(14-16)15-26-22(20,12-5-13-24(2)3)18-7-9-19(23)10-8-18/h6-11,14H,4-5,12-13,15H2,1-3H3