3-[4-(diethylamino)-2-methyl-phenyl]-6-(dimethylamino)-3-(4-piperidin-1-ylphenyl)-2-benzofuran-1-one

Systemtic Name: 3-[4-(diethylamino)-2-methyl-phenyl]-6-(dimethylamino)-3-(4-piperidin-1-ylphenyl)-2-benzofuran-1-one Openeye Name: 3-[4-(diethylamino)-2-methyl-phenyl]-6-(dimethylamino)-3-[4-(1-piperidyl)phenyl]isobenzofuran-1-one CAS Name: 3-[4-(diethylamino)-2-methylphenyl]-6-(dimethylamino)-3-[4-(1-piperidinyl)phenyl]-1-isobenzofuranone IUPAC Name: 3-[4-(diethylamino)-2-methylphenyl]-6-(dimethylamino)-3-(4-piperidin-1-ylphenyl)-2-benzofuran-1-one Traditional Name: 3-[4-(diethylamino)-2-methyl-phenyl]-6-(dimethylamino)-3-(4-piperidinophenyl)phthalide Formula: C32H39N3O2 MolecularWeight: 497.67096

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)C2(C3=C(C=C(C=C3)N(C)C)C(=O)O2)C4=CC=C(C=C4)N5CCCCC5)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)C2(C3=C(C=C(C=C3)N(C)C)C(=O)O2)C4=CC=C(C=C4)N5CCCCC5)C

InChI

InChI=1S/C32H39N3O2/c1-6-34(7-2)27-16-17-29(23(3)21-27)32(24-11-13-25(14-12-24)35-19-9-8-10-20-35)30-18-15-26(33(4)5)22-28(30)31(36)37-32/h11-18,21-22H,6-10,19-20H2,1-5H3