3-(4-methoxyphenyl)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]propan-1-one

Systemtic Name: 3-(4-methoxyphenyl)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]propan-1-one Openeye Name: 3-(4-methoxyphenyl)-1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]propan-1-one CAS Name: 3-(4-methoxyphenyl)-1-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 3-(4-methoxyphenyl)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]propan-1-one Traditional Name: 3-(4-methoxyphenyl)-1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]propan-1-one Formula: C25H29N2O2+ MolecularWeight: 389.50996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H28N2O2/c1-29-23-12-9-20(10-13-23)11-14-25(28)27-17-15-26(16-18-27)19-22-7-4-6-21-5-2-3-8-24(21)22/h2-10,12-13H,11,14-19H2,1H3/p+1