[6-[hexyl(methyl)carbamoyl]oxy-2,3-dihydro-1H-inden-1-yl]-prop-2-ynyl-azanium chloride

Systemtic Name: [6-[hexyl(methyl)carbamoyl]oxy-2,3-dihydro-1H-inden-1-yl]-prop-2-ynyl-azanium chloride Openeye Name: [6-[hexyl(methyl)carbamoyl]oxyindan-1-yl]-prop-2-ynyl-ammonium chloride CAS Name: [6-[[hexyl(methyl)amino]-oxomethoxy]-2,3-dihydro-1H-inden-1-yl]-prop-2-ynylammonium chloride IUPAC Name: [6-[hexyl(methyl)carbamoyl]oxy-2,3-dihydro-1H-inden-1-yl]-prop-2-ynylazanium chloride Traditional Name: [6-[hexyl(methyl)carbamoyl]oxyindan-1-yl]-propargyl-ammonium chloride Formula: C20H29ClN2O2 MolecularWeight: 364.90946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C)C(=O)OC1=CC2=C(CCC2[NH2+]CC#C)C=C1.[Cl-]

Isomeric SMILES

CCCCCCN(C)C(=O)OC1=CC2=C(CCC2[NH2+]CC#C)C=C1.[Cl-]

InChI

InChI=1S/C20H28N2O2.ClH/c1-4-6-7-8-14-22(3)20(23)24-17-11-9-16-10-12-19(18(16)15-17)21-13-5-2;/h2,9,11,15,19,21H,4,6-8,10,12-14H2,1,3H3;1H