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2,3-dihydro-1H-inden-5-yl-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]methanone

2,3-dihydro-1H-inden-5-yl-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name:2,3-dihydro-1H-inden-5-yl-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]methanone
Openeye Name:indan-5-yl-[4-(3-thienylmethyl)piperazin-4-ium-1-yl]methanone
CAS Name:2,3-dihydro-1H-inden-5-yl-[4-(3-thiophenylmethyl)-1-piperazin-4-iumyl]methanone
IUPAC Name:2,3-dihydro-1H-inden-5-yl-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]methanone
Traditional Name:indan-5-yl-[4-(3-thenyl)piperazin-4-ium-1-yl]methanone
Formula: C19H23N2OS+
MolecularWeight: 327.46372
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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)N3CC[NH+](CC3)CC4=CSC=C4


Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)N3CC[NH+](CC3)CC4=CSC=C4


InChI

InChI=1S/C19H22N2OS/c22-19(18-5-4-16-2-1-3-17(16)12-18)21-9-7-20(8-10-21)13-15-6-11-23-14-15/h4-6,11-12,14H,1-3,7-10,13H2/p+1


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