3-[[(3S)-1-(3-chloranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(3S)-1-(3-chloranyl-4-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[(3S)-1-(3-chloro-4-methyl-phenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[(3S)-1-(3-chloro-4-methylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(3S)-1-(3-chloro-4-methylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(3S)-1-(3-chloro-4-methyl-phenyl)-5-keto-pyrrolidine-3-carbonyl]amino]propyl-dimethyl-ammonium Formula: C17H25ClN3O2+ MolecularWeight: 338.8523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NCCC[NH+](C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C[C@H](CC2=O)C(=O)NCCC[NH+](C)C)Cl

InChI

InChI=1S/C17H24ClN3O2/c1-12-5-6-14(10-15(12)18)21-11-13(9-16(21)22)17(23)19-7-4-8-20(2)3/h5-6,10,13H,4,7-9,11H2,1-3H3,(H,19,23)/p+1/t13-/m0/s1