(3S)-N-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-1-(3-phenylpropyl)piperidin-3-amine

Systemtic Name: (3S)-N-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-1-(3-phenylpropyl)piperidin-3-amine Openeye Name: (3S)-N-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-1-(3-phenylpropyl)piperidin-3-amine CAS Name: (3S)-N-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-1-(3-phenylpropyl)-3-piperidinamine IUPAC Name: (3S)-N-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-1-(3-phenylpropyl)piperidin-3-amine Traditional Name: (2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl-[(3S)-1-(3-phenylpropyl)-3-piperidyl]amine Formula: C20H31N4+ MolecularWeight: 327.48694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=CN1)CNC2CCCN(C2)CCCC3=CC=CC=C3)C

Isomeric SMILES

CC1=[N+](C(=CN1)CN[C@H]2CCCN(C2)CCCC3=CC=CC=C3)C

InChI

InChI=1S/C20H30N4/c1-17-21-14-20(23(17)2)15-22-19-11-7-13-24(16-19)12-6-10-18-8-4-3-5-9-18/h3-5,8-9,14,19,22H,6-7,10-13,15-16H2,1-2H3/p+1/t19-/m0/s1