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

Systemtic Name: 3,5-dimethyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,2-oxazole Openeye Name: 3,5-dimethyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]isoxazole CAS Name: 3,5-dimethyl-4-[(4-phenyl-1-piperazin-1-iumyl)methyl]isoxazole IUPAC Name: 3,5-dimethyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,2-oxazole Traditional Name: 3,5-dimethyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]isoxazole Formula: C16H22N3O+ MolecularWeight: 272.36538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O/c1-13-16(14(2)20-17-13)12-18-8-10-19(11-9-18)15-6-4-3-5-7-15/h3-7H,8-12H2,1-2H3/p+1