[4-(5-methylpyrazol-1-yl)phenyl]-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [4-(5-methylpyrazol-1-yl)phenyl]-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: [4-(5-methylpyrazol-1-yl)phenyl]-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [4-(5-methyl-1-pyrazolyl)phenyl]-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: [4-(5-methylpyrazol-1-yl)phenyl]-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: [4-(5-methylpyrazol-1-yl)phenyl]-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]methanone Formula: C26H27N4O+ MolecularWeight: 411.51878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1C2=CC=C(C=C2)C(=O)N3CC[NH+](CC3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=CC=NN1C2=CC=C(C=C2)C(=O)N3CC[NH+](CC3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H26N4O/c1-20-13-14-27-30(20)24-11-9-22(10-12-24)26(31)29-17-15-28(16-18-29)19-23-7-4-6-21-5-2-3-8-25(21)23/h2-14H,15-19H2,1H3/p+1