1-[4-[(4-methoxynaphthalen-1-yl)methyl]piperazin-4-ium-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-[(4-methoxynaphthalen-1-yl)methyl]piperazin-4-ium-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-[(4-methoxy-1-naphthyl)methyl]piperazin-4-ium-1-yl]-3-methyl-butan-1-one CAS Name: 1-[4-[(4-methoxy-1-naphthalenyl)methyl]-1-piperazin-4-iumyl]-3-methyl-1-butanone IUPAC Name: 1-[4-[(4-methoxynaphthalen-1-yl)methyl]piperazin-4-ium-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-[(4-methoxy-1-naphthyl)methyl]piperazin-4-ium-1-yl]-3-methyl-butan-1-one Formula: C21H29N2O2+ MolecularWeight: 341.46716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CC[NH+](CC1)CC2=CC=C(C3=CC=CC=C23)OC

Isomeric SMILES

CC(C)CC(=O)N1CC[NH+](CC1)CC2=CC=C(C3=CC=CC=C23)OC

InChI

InChI=1S/C21H28N2O2/c1-16(2)14-21(24)23-12-10-22(11-13-23)15-17-8-9-20(25-3)19-7-5-4-6-18(17)19/h4-9,16H,10-15H2,1-3H3/p+1