(3S,4R)-3-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-1-methyl-piperidin-1-ium-4-ol

Systemtic Name: (3S,4R)-3-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-1-methyl-piperidin-1-ium-4-ol Openeye Name: (3S,4R)-3-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-1-methyl-piperidin-1-ium-4-ol CAS Name: (3S,4R)-3-[[4-(2,3-dimethylphenyl)-1-piperazin-1-iumyl]methyl]-1-methyl-4-piperidin-1-iumol IUPAC Name: (3S,4R)-3-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-1-methylpiperidin-1-ium-4-ol Traditional Name: (3S,4R)-3-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]-1-methyl-piperidin-1-ium-4-ol Formula: C19H33N3O+2 MolecularWeight: 319.48482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC3C[NH+](CCC3O)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CC[NH+](CC2)C[C@@H]3C[NH+](CC[C@H]3O)C)C

InChI

InChI=1S/C19H31N3O/c1-15-5-4-6-18(16(15)2)22-11-9-21(10-12-22)14-17-13-20(3)8-7-19(17)23/h4-6,17,19,23H,7-14H2,1-3H3/p+2/t17-,19+/m0/s1