(2,5-dimethylphenyl)-[(2R)-pyrrolidin-1-ium-2-yl]methanone

Systemtic Name: (2,5-dimethylphenyl)-[(2R)-pyrrolidin-1-ium-2-yl]methanone Openeye Name: (2,5-dimethylphenyl)-[(2R)-pyrrolidin-1-ium-2-yl]methanone CAS Name: (2,5-dimethylphenyl)-[(2R)-2-pyrrolidin-1-iumyl]methanone IUPAC Name: (2,5-dimethylphenyl)-[(2R)-pyrrolidin-1-ium-2-yl]methanone Traditional Name: (2,5-dimethylphenyl)-[(2R)-pyrrolidin-1-ium-2-yl]methanone Formula: C13H18NO+ MolecularWeight: 204.28812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)C2CCC[NH2+]2

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)[C@H]2CCC[NH2+]2

InChI

InChI=1S/C13H17NO/c1-9-5-6-10(2)11(8-9)13(15)12-4-3-7-14-12/h5-6,8,12,14H,3-4,7H2,1-2H3/p+1/t12-/m1/s1