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

Systemtic Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-2-(4-phenylphenyl)ethyl]piperazin-4-ium-1-yl]-naphthalen-1-yl-methanone Openeye Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-2-(4-phenylphenyl)ethyl]piperazin-4-ium-1-yl]-(1-naphthyl)methanone CAS Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-2-(4-phenylphenyl)ethyl]-1-piperazin-4-iumyl]-(1-naphthalenyl)methanone IUPAC Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-2-(4-phenylphenyl)ethyl]piperazin-4-ium-1-yl]-naphthalen-1-ylmethanone Traditional Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-2-(4-phenylphenyl)ethyl]piperazin-4-ium-1-yl]-(1-naphthyl)methanone Formula: C36H39N4O+ MolecularWeight: 543.72106

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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)C5=CC=CC=C5)C6=CN=CN6

Isomeric SMILES

CCCC[N+]1(CCN(CC1)C(=O)C2=CC=CC3=CC=CC=C32)C(CC4=CC=C(C=C4)C5=CC=CC=C5)C6=CN=CN6

InChI

InChI=1S/C36H39N4O/c1-2-3-22-40(23-20-39(21-24-40)36(41)33-15-9-13-31-12-7-8-14-32(31)33)35(34-26-37-27-38-34)25-28-16-18-30(19-17-28)29-10-5-4-6-11-29/h4-19,26-27,35H,2-3,20-25H2,1H3,(H,37,38)/q+1