1-(3-oxidanylpropyl)-N-(2,4,6-trimethylphenyl)pyrrolidin-1-ium-2-carboxamide chloride

Systemtic Name: 1-(3-oxidanylpropyl)-N-(2,4,6-trimethylphenyl)pyrrolidin-1-ium-2-carboxamide chloride Openeye Name: 1-(3-hydroxypropyl)-N-(2,4,6-trimethylphenyl)pyrrolidin-1-ium-2-carboxamide chloride CAS Name: 1-(3-hydroxypropyl)-N-(2,4,6-trimethylphenyl)-2-pyrrolidin-1-iumcarboxamide chloride IUPAC Name: 1-(3-hydroxypropyl)-N-(2,4,6-trimethylphenyl)pyrrolidin-1-ium-2-carboxamide chloride Traditional Name: 1-(3-hydroxypropyl)-N-mesityl-pyrrolidin-1-ium-2-carboxamide chloride Formula: C17H27ClN2O2 MolecularWeight: 326.86148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C2CCC[NH+]2CCCO)C.[Cl-]

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2CCC[NH+]2CCCO)C.[Cl-]

InChI

InChI=1S/C17H26N2O2.ClH/c1-12-10-13(2)16(14(3)11-12)18-17(21)15-6-4-7-19(15)8-5-9-20;/h10-11,15,20H,4-9H2,1-3H3,(H,18,21);1H