2-[2,3-dimethyl-1-(phenylmethyl)indol-5-yl]carbonyloxyethyl-diethyl-azanium chloride

Systemtic Name: 2-[2,3-dimethyl-1-(phenylmethyl)indol-5-yl]carbonyloxyethyl-diethyl-azanium chloride Openeye Name: 2-(1-benzyl-2,3-dimethyl-indole-5-carbonyl)oxyethyl-diethyl-ammonium chloride CAS Name: 2-[[2,3-dimethyl-1-(phenylmethyl)-5-indolyl]-oxomethoxy]ethyl-diethylammonium chloride IUPAC Name: 2-(1-benzyl-2,3-dimethylindole-5-carbonyl)oxyethyl-diethylazanium chloride Traditional Name: 2-(1-benzyl-2,3-dimethyl-indole-5-carbonyl)oxyethyl-diethyl-ammonium chloride Formula: C24H31ClN2O2 MolecularWeight: 414.96814

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC(=O)C1=CC2=C(C=C1)N(C(=C2C)C)CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCOC(=O)C1=CC2=C(C=C1)N(C(=C2C)C)CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C24H30N2O2.ClH/c1-5-25(6-2)14-15-28-24(27)21-12-13-23-22(16-21)18(3)19(4)26(23)17-20-10-8-7-9-11-20;/h7-13,16H,5-6,14-15,17H2,1-4H3;1H