(1S)-1-(2,5-dimethylphenyl)-2-pyrrolidin-1-ium-1-yl-ethanamine

Systemtic Name: (1S)-1-(2,5-dimethylphenyl)-2-pyrrolidin-1-ium-1-yl-ethanamine Openeye Name: (1S)-1-(2,5-dimethylphenyl)-2-pyrrolidin-1-ium-1-yl-ethanamine CAS Name: (1S)-1-(2,5-dimethylphenyl)-2-(1-pyrrolidin-1-iumyl)ethanamine IUPAC Name: (1S)-1-(2,5-dimethylphenyl)-2-pyrrolidin-1-ium-1-ylethanamine Traditional Name: [(1S)-1-(2,5-dimethylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]amine Formula: C14H23N2+ MolecularWeight: 219.34582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C[NH+]2CCCC2)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)[C@@H](C[NH+]2CCCC2)N

InChI

InChI=1S/C14H22N2/c1-11-5-6-12(2)13(9-11)14(15)10-16-7-3-4-8-16/h5-6,9,14H,3-4,7-8,10,15H2,1-2H3/p+1/t14-/m1/s1