4-(2-methylphenoxy)-1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-1-ium

Systemtic Name: 4-(2-methylphenoxy)-1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-1-ium Openeye Name: 4-(2-methylphenoxy)-1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-1-ium CAS Name: 4-(2-methylphenoxy)-1-[2-(3-methyl-1-pyrazolyl)ethyl]piperidin-1-ium IUPAC Name: 4-(2-methylphenoxy)-1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-1-ium Traditional Name: 4-(2-methylphenoxy)-1-[2-(3-methylpyrazol-1-yl)ethyl]piperidin-1-ium Formula: C18H26N3O+ MolecularWeight: 300.41854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)CC[NH+]2CCC(CC2)OC3=CC=CC=C3C

Isomeric SMILES

CC1=NN(C=C1)CC[NH+]2CCC(CC2)OC3=CC=CC=C3C

InChI

InChI=1S/C18H25N3O/c1-15-5-3-4-6-18(15)22-17-8-10-20(11-9-17)13-14-21-12-7-16(2)19-21/h3-7,12,17H,8-11,13-14H2,1-2H3/p+1