naphthalen-2-yl-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: naphthalen-2-yl-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: 2-naphthyl-[4-(3-thienylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: 2-naphthalenyl-[4-(3-thiophenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: naphthalen-2-yl-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: 2-naphthyl-[4-(3-thenyl)piperazin-4-ium-1-yl]methanone Formula: C20H21N2OS+ MolecularWeight: 337.45854

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CSC=C2)C(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CSC=C2)C(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C20H20N2OS/c23-20(19-6-5-17-3-1-2-4-18(17)13-19)22-10-8-21(9-11-22)14-16-7-12-24-15-16/h1-7,12-13,15H,8-11,14H2/p+1