[(1S)-1-(3-ethyl-1-benzofuran-2-yl)ethyl]-[(1S,2S)-2-methylcyclohexyl]azanium

Systemtic Name: [(1S)-1-(3-ethyl-1-benzofuran-2-yl)ethyl]-[(1S,2S)-2-methylcyclohexyl]azanium Openeye Name: [(1S)-1-(3-ethylbenzofuran-2-yl)ethyl]-[(1S,2S)-2-methylcyclohexyl]ammonium CAS Name: [(1S)-1-(3-ethyl-2-benzofuranyl)ethyl]-[(1S,2S)-2-methylcyclohexyl]ammonium IUPAC Name: [(1S)-1-(3-ethyl-1-benzofuran-2-yl)ethyl]-[(1S,2S)-2-methylcyclohexyl]azanium Traditional Name: [(1S)-1-(3-ethylbenzofuran-2-yl)ethyl]-[(1S,2S)-2-methylcyclohexyl]ammonium Formula: C19H28NO+ MolecularWeight: 286.43172

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(OC2=CC=CC=C21)C(C)[NH2+]C3CCCCC3C

Isomeric SMILES

CCC1=C(OC2=CC=CC=C21)[C@H](C)[NH2+][C@H]3CCCC[C@@H]3C

InChI

InChI=1S/C19H27NO/c1-4-15-16-10-6-8-12-18(16)21-19(15)14(3)20-17-11-7-5-9-13(17)2/h6,8,10,12-14,17,20H,4-5,7,9,11H2,1-3H3/p+1/t13-,14-,17-/m0/s1