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1-[(S)-(4-methylphenyl)-[3-(phenylmethyl)-1H-imidazol-3-ium-2-yl]methyl]piperazine
1-[(S)-(4-methylphenyl)-[3-(phenylmethyl)-1H-imidazol-3-ium-2-yl]methyl]piperazine
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC=C(C=C1)C(C2=[N+](C=CN2)CC3=CC=CC=C3)N4CCNCC4
Isomeric SMILES
CC1=CC=C(C=C1)[C@@H](C2=[N+](C=CN2)CC3=CC=CC=C3)N4CCNCC4
InChI
InChI=1S/C22H26N4/c1-18-7-9-20(10-8-18)21(25-14-11-23-12-15-25)22-24-13-16-26(22)17-19-5-3-2-4-6-19/h2-10,13,16,21,23H,11-12,14-15,17H2,1H3/p+1/t21-/m0/s1
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