4-[[4-(diphenylmethyl)piperazin-1-ium-1-yl]methyl]-3,5-dimethyl-1,2-oxazole

Systemtic Name: 4-[[4-(diphenylmethyl)piperazin-1-ium-1-yl]methyl]-3,5-dimethyl-1,2-oxazole Openeye Name: 4-[(4-benzhydrylpiperazin-1-ium-1-yl)methyl]-3,5-dimethyl-isoxazole CAS Name: 4-[[4-(diphenylmethyl)-1-piperazin-1-iumyl]methyl]-3,5-dimethylisoxazole IUPAC Name: 4-[(4-benzhydrylpiperazin-1-ium-1-yl)methyl]-3,5-dimethyl-1,2-oxazole Traditional Name: 4-[(4-benzhydrylpiperazin-1-ium-1-yl)methyl]-3,5-dimethyl-isoxazole Formula: C23H28N3O+ MolecularWeight: 362.48792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C[NH+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C)C[NH+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H27N3O/c1-18-22(19(2)27-24-18)17-25-13-15-26(16-14-25)23(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,23H,13-17H2,1-2H3/p+1