4-[(4,4-dimethylpiperazin-4-ium-1-yl)-(4-propan-2-ylphenyl)methyl]-3,5-dimethyl-1,2-oxazole

Systemtic Name: 4-[(4,4-dimethylpiperazin-4-ium-1-yl)-(4-propan-2-ylphenyl)methyl]-3,5-dimethyl-1,2-oxazole Openeye Name: 4-[(4,4-dimethylpiperazin-4-ium-1-yl)-(4-isopropylphenyl)methyl]-3,5-dimethyl-isoxazole CAS Name: 4-[(4,4-dimethyl-1-piperazin-4-iumyl)-(4-propan-2-ylphenyl)methyl]-3,5-dimethylisoxazole IUPAC Name: 4-[(4,4-dimethylpiperazin-4-ium-1-yl)-(4-propan-2-ylphenyl)methyl]-3,5-dimethyl-1,2-oxazole Traditional Name: 4-[(4,4-dimethylpiperazin-4-ium-1-yl)-p-cumenyl-methyl]-3,5-dimethyl-isoxazole Formula: C21H32N3O+ MolecularWeight: 342.49828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(C2=CC=C(C=C2)C(C)C)N3CC[N+](CC3)(C)C

Isomeric SMILES

CC1=C(C(=NO1)C)C(C2=CC=C(C=C2)C(C)C)N3CC[N+](CC3)(C)C

InChI

InChI=1S/C21H32N3O/c1-15(2)18-7-9-19(10-8-18)21(20-16(3)22-25-17(20)4)23-11-13-24(5,6)14-12-23/h7-10,15,21H,11-14H2,1-6H3/q+1