[4-butyl-4-[1-(1H-imidazol-5-yl)-2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]-naphthalen-1-yl-methanone

Systemtic Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]-naphthalen-1-yl-methanone Openeye Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]-(1-naphthyl)methanone CAS Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-2-(4-methoxyphenyl)ethyl]-1-piperazin-4-iumyl]-(1-naphthalenyl)methanone IUPAC Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]-naphthalen-1-ylmethanone Traditional Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]-(1-naphthyl)methanone Formula: C31H37N4O2+ MolecularWeight: 497.65108

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(CCN(CC1)C(=O)C2=CC=CC3=CC=CC=C32)C(CC4=CC=C(C=C4)OC)C5=CN=CN5

Isomeric SMILES

CCCC[N+]1(CCN(CC1)C(=O)C2=CC=CC3=CC=CC=C32)C(CC4=CC=C(C=C4)OC)C5=CN=CN5

InChI

InChI=1S/C31H37N4O2/c1-3-4-18-35(30(29-22-32-23-33-29)21-24-12-14-26(37-2)15-13-24)19-16-34(17-20-35)31(36)28-11-7-9-25-8-5-6-10-27(25)28/h5-15,22-23,30H,3-4,16-21H2,1-2H3,(H,32,33)/q+1