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

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

Systemtic Name:1-[(S)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methyl]piperazin-4-ium
Openeye Name:1-[(S)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methyl]piperazin-4-ium
CAS Name:1-[(S)-(3-methoxyphenyl)-(1-methyl-2-pyrrolyl)methyl]piperazin-4-ium
IUPAC Name:1-[(S)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methyl]piperazin-4-ium
Traditional Name:1-[(S)-(3-methoxyphenyl)-(1-methylpyrrol-2-yl)methyl]piperazin-4-ium
Formula: C17H24N3O+
MolecularWeight: 286.39196
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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(C2=CC(=CC=C2)OC)N3CC[NH2+]CC3


Isomeric SMILES

CN1C=CC=C1[C@H](C2=CC(=CC=C2)OC)N3CC[NH2+]CC3


InChI

InChI=1S/C17H23N3O/c1-19-10-4-7-16(19)17(20-11-8-18-9-12-20)14-5-3-6-15(13-14)21-2/h3-7,10,13,17-18H,8-9,11-12H2,1-2H3/p+1/t17-/m0/s1


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