[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone

Systemtic Name: [4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone Openeye Name: (5-methyl-3-phenyl-isoxazol-4-yl)-[4-(m-tolylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (5-methyl-3-phenyl-4-isoxazolyl)-[4-[(3-methylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: [4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone Traditional Name: [4-(3-methylbenzyl)piperazin-4-ium-1-yl]-(5-methyl-3-phenyl-isoxazol-4-yl)methanone Formula: C23H26N3O2+ MolecularWeight: 376.47144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=O)C3=C(ON=C3C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=O)C3=C(ON=C3C4=CC=CC=C4)C

InChI

InChI=1S/C23H25N3O2/c1-17-7-6-8-19(15-17)16-25-11-13-26(14-12-25)23(27)21-18(2)28-24-22(21)20-9-4-3-5-10-20/h3-10,15H,11-14,16H2,1-2H3/p+1