[4-butyl-4-[1-(1H-imidazol-5-yl)-3-phenyl-propyl]piperazin-4-ium-1-yl]-naphthalen-1-yl-methanone

Systemtic Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-3-phenyl-propyl]piperazin-4-ium-1-yl]-naphthalen-1-yl-methanone Openeye Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-3-phenyl-propyl]piperazin-4-ium-1-yl]-(1-naphthyl)methanone CAS Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-3-phenylpropyl]-1-piperazin-4-iumyl]-(1-naphthalenyl)methanone IUPAC Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-3-phenylpropyl]piperazin-4-ium-1-yl]-naphthalen-1-ylmethanone Traditional Name: [4-butyl-4-[1-(1H-imidazol-5-yl)-3-phenyl-propyl]piperazin-4-ium-1-yl]-(1-naphthyl)methanone Formula: C31H37N4O+ MolecularWeight: 481.65168

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(CCN(CC1)C(=O)C2=CC=CC3=CC=CC=C32)C(CCC4=CC=CC=C4)C5=CN=CN5

Isomeric SMILES

CCCC[N+]1(CCN(CC1)C(=O)C2=CC=CC3=CC=CC=C32)C(CCC4=CC=CC=C4)C5=CN=CN5

InChI

InChI=1S/C31H37N4O/c1-2-3-20-35(30(29-23-32-24-33-29)17-16-25-10-5-4-6-11-25)21-18-34(19-22-35)31(36)28-15-9-13-26-12-7-8-14-27(26)28/h4-15,23-24,30H,2-3,16-22H2,1H3,(H,32,33)/q+1