(2R,4S)-4-(4-bromophenyl)-2-prop-2-enyl-pyrrolidin-1-ium chloride

Systemtic Name: (2R,4S)-4-(4-bromophenyl)-2-prop-2-enyl-pyrrolidin-1-ium chloride Openeye Name: (2R,4S)-2-allyl-4-(4-bromophenyl)pyrrolidin-1-ium chloride CAS Name: (2R,4S)-4-(4-bromophenyl)-2-prop-2-enylpyrrolidin-1-ium chloride IUPAC Name: (2R,4S)-4-(4-bromophenyl)-2-prop-2-enylpyrrolidin-1-ium chloride Traditional Name: (2R,4S)-2-allyl-4-(4-bromophenyl)pyrrolidin-1-ium chloride Formula: C13H17BrClN MolecularWeight: 302.63778

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1CC(C[NH2+]1)C2=CC=C(C=C2)Br.[Cl-]

Isomeric SMILES

C=CC[C@@H]1C[C@H](C[NH2+]1)C2=CC=C(C=C2)Br.[Cl-]

InChI

InChI=1S/C13H16BrN.ClH/c1-2-3-13-8-11(9-15-13)10-4-6-12(14)7-5-10;/h2,4-7,11,13,15H,1,3,8-9H2;1H/t11-,13-;/m1./s1