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

Systemtic Name: (3S)-N-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-amine Openeye Name: (3S)-N-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-amine CAS Name: (3S)-N-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-1-[(3-methoxyphenyl)methyl]-3-piperidin-1-iumamine IUPAC Name: (3S)-N-[(2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl]-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-amine Traditional Name: (2,3-dimethyl-1H-imidazol-3-ium-4-yl)methyl-[(3S)-1-m-anisylpiperidin-1-ium-3-yl]amine Formula: C19H30N4O+2 MolecularWeight: 330.4677

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=CN1)CNC2CCC[NH+](C2)CC3=CC(=CC=C3)OC)C

Isomeric SMILES

CC1=[N+](C(=CN1)CN[C@H]2CCC[NH+](C2)CC3=CC(=CC=C3)OC)C

InChI

InChI=1S/C19H28N4O/c1-15-20-11-18(22(15)2)12-21-17-7-5-9-23(14-17)13-16-6-4-8-19(10-16)24-3/h4,6,8,10-11,17,21H,5,7,9,12-14H2,1-3H3/p+2/t17-/m0/s1