3,6,6-trimethyl-2-(4-phenylpiperazin-1-yl)carbonyl-5,7-dihydro-1-benzofuran-4-one

Systemtic Name: 3,6,6-trimethyl-2-(4-phenylpiperazin-1-yl)carbonyl-5,7-dihydro-1-benzofuran-4-one Openeye Name: 3,6,6-trimethyl-2-(4-phenylpiperazine-1-carbonyl)-5,7-dihydrobenzofuran-4-one CAS Name: 3,6,6-trimethyl-2-[oxo-(4-phenyl-1-piperazinyl)methyl]-5,7-dihydrobenzofuran-4-one IUPAC Name: 3,6,6-trimethyl-2-(4-phenylpiperazine-1-carbonyl)-5,7-dihydro-1-benzofuran-4-one Traditional Name: 3,6,6-trimethyl-2-(4-phenylpiperazine-1-carbonyl)-5,7-dihydrobenzofuran-4-one Formula: C22H26N2O3 MolecularWeight: 366.45344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H26N2O3/c1-15-19-17(25)13-22(2,3)14-18(19)27-20(15)21(26)24-11-9-23(10-12-24)16-7-5-4-6-8-16/h4-8H,9-14H2,1-3H3