1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propan-1-one

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propan-1-one Openeye Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-[5-(p-tolyl)oxazol-2-yl]propan-1-one CAS Name: 1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-3-[5-(4-methylphenyl)-2-oxazolyl]-1-propanone IUPAC Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propan-1-one Traditional Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-[5-(p-tolyl)oxazol-2-yl]propan-1-one Formula: C30H32N3O2+ MolecularWeight: 466.59398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CN=C(O2)CCC(=O)N3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CN=C(O2)CCC(=O)N3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H31N3O2/c1-23-12-14-24(15-13-23)27-22-31-28(35-27)16-17-29(34)32-18-20-33(21-19-32)30(25-8-4-2-5-9-25)26-10-6-3-7-11-26/h2-15,22,30H,16-21H2,1H3/p+1