N-[4,6-dimethyl-1-(3-methylbutyl)-2,3-dihydro-1H-indol-1-ium-7-yl]-2,2-dimethyl-propanamide chloride

Systemtic Name: N-[4,6-dimethyl-1-(3-methylbutyl)-2,3-dihydro-1H-indol-1-ium-7-yl]-2,2-dimethyl-propanamide chloride Openeye Name: N-(1-isopentyl-4,6-dimethyl-indolin-1-ium-7-yl)-2,2-dimethyl-propanamide chloride CAS Name: N-[4,6-dimethyl-1-(3-methylbutyl)-2,3-dihydro-1H-indol-1-ium-7-yl]-2,2-dimethylpropanamide chloride IUPAC Name: N-[4,6-dimethyl-1-(3-methylbutyl)-2,3-dihydro-1H-indol-1-ium-7-yl]-2,2-dimethylpropanamide chloride Traditional Name: N-(1-isoamyl-4,6-dimethyl-indolin-1-ium-7-yl)-2,2-dimethyl-propionamide chloride Formula: C20H33ClN2O MolecularWeight: 352.94182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1CC[NH+]2CCC(C)C)NC(=O)C(C)(C)C)C.[Cl-]

Isomeric SMILES

CC1=CC(=C(C2=C1CC[NH+]2CCC(C)C)NC(=O)C(C)(C)C)C.[Cl-]

InChI

InChI=1S/C20H32N2O.ClH/c1-13(2)8-10-22-11-9-16-14(3)12-15(4)17(18(16)22)21-19(23)20(5,6)7;/h12-13H,8-11H2,1-7H3,(H,21,23);1H