2-[4-(diphenylmethyl)piperazin-1-yl]carbonyl-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-4-one

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-yl]carbonyl-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-4-one Openeye Name: 2-(4-benzhydrylpiperazine-1-carbonyl)-3,6,6-trimethyl-5,7-dihydrobenzofuran-4-one CAS Name: 2-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]-3,6,6-trimethyl-5,7-dihydrobenzofuran-4-one IUPAC Name: 2-(4-benzhydrylpiperazine-1-carbonyl)-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-4-one Traditional Name: 2-(4-benzhydrylpiperazine-1-carbonyl)-3,6,6-trimethyl-5,7-dihydrobenzofuran-4-one Formula: C29H32N2O3 MolecularWeight: 456.57598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H32N2O3/c1-20-25-23(32)18-29(2,3)19-24(25)34-27(20)28(33)31-16-14-30(15-17-31)26(21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-13,26H,14-19H2,1-3H3