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1-[(S)-(4-methoxyphenyl)-(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-4-ium

1-[(S)-(4-methoxyphenyl)-(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-4-ium

Systemtic Name:1-[(S)-(4-methoxyphenyl)-(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-4-ium
Openeye Name:1-[(S)-(4-methoxyphenyl)-(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-4-ium
CAS Name:1-[(S)-(4-methoxyphenyl)-(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-4-ium
IUPAC Name:1-[(S)-(4-methoxyphenyl)-(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-4-ium
Traditional Name:1-[(S)-(4-methoxyphenyl)-(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-4-ium
Formula: C16H24N4O+2
MolecularWeight: 288.38796
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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC=C1)C(C2=CC=C(C=C2)OC)N3CC[NH2+]CC3


Isomeric SMILES

C[N+]1=C(NC=C1)[C@H](C2=CC=C(C=C2)OC)N3CC[NH2+]CC3


InChI

InChI=1S/C16H22N4O/c1-19-10-9-18-16(19)15(20-11-7-17-8-12-20)13-3-5-14(21-2)6-4-13/h3-6,9-10,15,17H,7-8,11-12H2,1-2H3/p+2/t15-/m0/s1


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