[(1S)-1-(4-bromophenyl)propyl]-[(2S)-3-methyl-2-pyrrolidin-1-yl-butyl]azanium

Systemtic Name: [(1S)-1-(4-bromophenyl)propyl]-[(2S)-3-methyl-2-pyrrolidin-1-yl-butyl]azanium Openeye Name: [(1S)-1-(4-bromophenyl)propyl]-[(2S)-3-methyl-2-pyrrolidin-1-yl-butyl]ammonium CAS Name: [(1S)-1-(4-bromophenyl)propyl]-[(2S)-3-methyl-2-(1-pyrrolidinyl)butyl]ammonium IUPAC Name: [(1S)-1-(4-bromophenyl)propyl]-[(2S)-3-methyl-2-pyrrolidin-1-ylbutyl]azanium Traditional Name: [(1S)-1-(4-bromophenyl)propyl]-[(2S)-3-methyl-2-pyrrolidino-butyl]ammonium Formula: C18H30BrN2+ MolecularWeight: 354.3482

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Br)[NH2+]CC(C(C)C)N2CCCC2

Isomeric SMILES

CC[C@@H](C1=CC=C(C=C1)Br)[NH2+]C[C@H](C(C)C)N2CCCC2

InChI

InChI=1S/C18H29BrN2/c1-4-17(15-7-9-16(19)10-8-15)20-13-18(14(2)3)21-11-5-6-12-21/h7-10,14,17-18,20H,4-6,11-13H2,1-3H3/p+1/t17-,18+/m0/s1