[3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: [3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: [3-[(3,5-dimethylisoxazol-4-yl)methoxy]phenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: [3-[(3,5-dimethyl-4-isoxazolyl)methoxy]phenyl]-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: [3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: [3-[(3,5-dimethylisoxazol-4-yl)methoxy]phenyl]-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C22H25N4O3+ MolecularWeight: 393.4589

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

CC1=C(C(=NO1)C)COC2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C22H24N4O3/c1-16-20(17(2)29-24-16)15-28-19-7-5-6-18(14-19)22(27)26-12-10-25(11-13-26)21-8-3-4-9-23-21/h3-9,14H,10-13,15H2,1-2H3/p+1