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

Systemtic Name: 3,6,6-trimethyl-2-(4-methylpiperazin-4-ium-1-yl)carbonyl-5,7-dihydro-1-benzofuran-4-one Openeye Name: 3,6,6-trimethyl-2-(4-methylpiperazin-4-ium-1-carbonyl)-5,7-dihydrobenzofuran-4-one CAS Name: 3,6,6-trimethyl-2-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-5,7-dihydrobenzofuran-4-one IUPAC Name: 3,6,6-trimethyl-2-(4-methylpiperazin-4-ium-1-carbonyl)-5,7-dihydro-1-benzofuran-4-one Traditional Name: 3,6,6-trimethyl-2-(4-methylpiperazin-4-ium-1-carbonyl)-5,7-dihydrobenzofuran-4-one Formula: C17H25N2O3+ MolecularWeight: 305.392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C17H24N2O3/c1-11-14-12(20)9-17(2,3)10-13(14)22-15(11)16(21)19-7-5-18(4)6-8-19/h5-10H2,1-4H3/p+1