2-[2-(5,6-dimethyl-1-benzofuran-3-yl)ethanoylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[2-(5,6-dimethyl-1-benzofuran-3-yl)ethanoylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[2-(5,6-dimethylbenzofuran-3-yl)acetyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[2-(5,6-dimethyl-3-benzofuranyl)-1-oxoethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[2-(5,6-dimethyl-1-benzofuran-3-yl)acetyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[2-(5,6-dimethylbenzofuran-3-yl)acetyl]amino]ethyl-diisopropyl-ammonium Formula: C20H31N2O2+ MolecularWeight: 331.47234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CO2)CC(=O)NCC[NH+](C(C)C)C(C)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CO2)CC(=O)NCC[NH+](C(C)C)C(C)C)C

InChI

InChI=1S/C20H30N2O2/c1-13(2)22(14(3)4)8-7-21-20(23)11-17-12-24-19-10-16(6)15(5)9-18(17)19/h9-10,12-14H,7-8,11H2,1-6H3,(H,21,23)/p+1