(2S)-2-(4-ethylphenyl)pyrrolidin-1-ium

Systemtic Name: (2S)-2-(4-ethylphenyl)pyrrolidin-1-ium Openeye Name: (2S)-2-(4-ethylphenyl)pyrrolidin-1-ium CAS Name: (2S)-2-(4-ethylphenyl)pyrrolidin-1-ium IUPAC Name: (2S)-2-(4-ethylphenyl)pyrrolidin-1-ium Traditional Name: (2S)-2-(4-ethylphenyl)pyrrolidin-1-ium Formula: C12H18N+ MolecularWeight: 176.27802

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2CCC[NH2+]2

Isomeric SMILES

CCC1=CC=C(C=C1)[C@@H]2CCC[NH2+]2

InChI

InChI=1S/C12H17N/c1-2-10-5-7-11(8-6-10)12-4-3-9-13-12/h5-8,12-13H,2-4,9H2,1H3/p+1/t12-/m0/s1