methyl-[2-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: methyl-[2-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium Openeye Name: methyl-[2-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-2-oxo-ethyl]-(2-thienylmethyl)ammonium CAS Name: methyl-[2-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-2-oxoethyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: methyl-[2-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-2-oxoethyl]-(thiophen-2-ylmethyl)azanium Traditional Name: [2-keto-2-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]ethyl]-methyl-(2-thenyl)ammonium Formula: C23H29N3OS+2 MolecularWeight: 395.56086

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CS1)CC(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C[NH+](CC1=CC=CS1)CC(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H27N3OS/c1-24(17-21-9-5-15-28-21)18-23(27)26-13-11-25(12-14-26)16-20-8-4-7-19-6-2-3-10-22(19)20/h2-10,15H,11-14,16-18H2,1H3/p+2