3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl-[1-(4-pyrazol-1-ylphenyl)piperidin-4-yl]azanium

Systemtic Name: 3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl-[1-(4-pyrazol-1-ylphenyl)piperidin-4-yl]azanium Openeye Name: 3-(3,5-dimethylisoxazol-4-yl)propyl-[1-(4-pyrazol-1-ylphenyl)-4-piperidyl]ammonium CAS Name: 3-(3,5-dimethyl-4-isoxazolyl)propyl-[1-[4-(1-pyrazolyl)phenyl]-4-piperidinyl]ammonium IUPAC Name: 3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl-[1-(4-pyrazol-1-ylphenyl)piperidin-4-yl]azanium Traditional Name: 3-(3,5-dimethylisoxazol-4-yl)propyl-[1-(4-pyrazol-1-ylphenyl)-4-piperidyl]ammonium Formula: C22H30N5O+ MolecularWeight: 380.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CCC[NH2+]C2CCN(CC2)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CC1=C(C(=NO1)C)CCC[NH2+]C2CCN(CC2)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C22H29N5O/c1-17-22(18(2)28-25-17)5-3-12-23-19-10-15-26(16-11-19)20-6-8-21(9-7-20)27-14-4-13-24-27/h4,6-9,13-14,19,23H,3,5,10-12,15-16H2,1-2H3/p+1