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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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