[2-[[(1S)-cyclohex-3-en-1-yl]methyl-(2,3-dihydro-1-benzofuran-5-ylmethyl)amino]-2-oxidanylidene-ethyl]-dimethyl-azanium

Systemtic Name: [2-[[(1S)-cyclohex-3-en-1-yl]methyl-(2,3-dihydro-1-benzofuran-5-ylmethyl)amino]-2-oxidanylidene-ethyl]-dimethyl-azanium Openeye Name: [2-[[(1S)-cyclohex-3-en-1-yl]methyl-(2,3-dihydrobenzofuran-5-ylmethyl)amino]-2-oxo-ethyl]-dimethyl-ammonium CAS Name: [2-[[(1S)-1-cyclohex-3-enyl]methyl-(2,3-dihydrobenzofuran-5-ylmethyl)amino]-2-oxoethyl]-dimethylammonium IUPAC Name: [2-[[(1S)-cyclohex-3-en-1-yl]methyl-(2,3-dihydro-1-benzofuran-5-ylmethyl)amino]-2-oxoethyl]-dimethylazanium Traditional Name: [2-[coumaran-5-ylmethyl-[[(1S)-cyclohex-3-en-1-yl]methyl]amino]-2-keto-ethyl]-dimethyl-ammonium Formula: C20H29N2O2+ MolecularWeight: 329.45646

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(=O)N(CC1CCC=CC1)CC2=CC3=C(C=C2)OCC3

Isomeric SMILES

C[NH+](C)CC(=O)N(C[C@H]1CCC=CC1)CC2=CC3=C(C=C2)OCC3

InChI

InChI=1S/C20H28N2O2/c1-21(2)15-20(23)22(13-16-6-4-3-5-7-16)14-17-8-9-19-18(12-17)10-11-24-19/h3-4,8-9,12,16H,5-7,10-11,13-15H2,1-2H3/p+1/t16-/m1/s1