dimethyl-[1-[[(3,6,7-trimethyl-1-benzofuran-2-yl)carbonylamino]methyl]cyclohexyl]azanium

Systemtic Name: dimethyl-[1-[[(3,6,7-trimethyl-1-benzofuran-2-yl)carbonylamino]methyl]cyclohexyl]azanium Openeye Name: dimethyl-[1-[[(3,6,7-trimethylbenzofuran-2-carbonyl)amino]methyl]cyclohexyl]ammonium CAS Name: dimethyl-[1-[[[oxo-(3,6,7-trimethyl-2-benzofuranyl)methyl]amino]methyl]cyclohexyl]ammonium IUPAC Name: dimethyl-[1-[[(3,6,7-trimethyl-1-benzofuran-2-carbonyl)amino]methyl]cyclohexyl]azanium Traditional Name: dimethyl-[1-[[(3,6,7-trimethylbenzofuran-2-carbonyl)amino]methyl]cyclohexyl]ammonium Formula: C21H31N2O2+ MolecularWeight: 343.48304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=C(O2)C(=O)NCC3(CCCCC3)[NH+](C)C)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=C(O2)C(=O)NCC3(CCCCC3)[NH+](C)C)C)C

InChI

InChI=1S/C21H30N2O2/c1-14-9-10-17-16(3)19(25-18(17)15(14)2)20(24)22-13-21(23(4)5)11-7-6-8-12-21/h9-10H,6-8,11-13H2,1-5H3,(H,22,24)/p+1