(3S)-1-[(2-butyl-1H-imidazol-3-ium-5-yl)methyl]-3-pyrrolidin-1-ium-1-yl-piperidine

Systemtic Name: (3S)-1-[(2-butyl-1H-imidazol-3-ium-5-yl)methyl]-3-pyrrolidin-1-ium-1-yl-piperidine Openeye Name: (3S)-1-[(2-butyl-1H-imidazol-3-ium-5-yl)methyl]-3-pyrrolidin-1-ium-1-yl-piperidine CAS Name: (3S)-1-[(2-butyl-1H-imidazol-3-ium-5-yl)methyl]-3-(1-pyrrolidin-1-iumyl)piperidine IUPAC Name: (3S)-1-[(2-butyl-1H-imidazol-3-ium-5-yl)methyl]-3-pyrrolidin-1-ium-1-ylpiperidine Traditional Name: (3S)-1-[(2-butyl-1H-imidazol-3-ium-5-yl)methyl]-3-pyrrolidin-1-ium-1-yl-piperidine Formula: C17H32N4+2 MolecularWeight: 292.46278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[NH+]C=C(N1)CN2CCCC(C2)[NH+]3CCCC3

Isomeric SMILES

CCCCC1=[NH+]C=C(N1)CN2CCC[C@@H](C2)[NH+]3CCCC3

InChI

InChI=1S/C17H30N4/c1-2-3-8-17-18-12-15(19-17)13-20-9-6-7-16(14-20)21-10-4-5-11-21/h12,16H,2-11,13-14H2,1H3,(H,18,19)/p+2/t16-/m0/s1