[(1R)-2-(2,3-dihydro-1H-inden-5-ylcarbonylamino)-1-(4-ethylphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-(2,3-dihydro-1H-inden-5-ylcarbonylamino)-1-(4-ethylphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1R)-1-(4-ethylphenyl)-2-(indane-5-carbonylamino)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[2,3-dihydro-1H-inden-5-yl(oxo)methyl]amino]-1-(4-ethylphenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-(2,3-dihydro-1H-indene-5-carbonylamino)-1-(4-ethylphenyl)ethyl]-dimethylazanium Traditional Name: [(1R)-1-(4-ethylphenyl)-2-(indane-5-carbonylamino)ethyl]-dimethyl-ammonium Formula: C22H29N2O+ MolecularWeight: 337.47846

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNC(=O)C2=CC3=C(CCC3)C=C2)[NH+](C)C

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](CNC(=O)C2=CC3=C(CCC3)C=C2)[NH+](C)C

InChI

InChI=1S/C22H28N2O/c1-4-16-8-10-18(11-9-16)21(24(2)3)15-23-22(25)20-13-12-17-6-5-7-19(17)14-20/h8-14,21H,4-7,15H2,1-3H3,(H,23,25)/p+1/t21-/m0/s1