(2-phenoxypyridin-3-yl)methyl-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (2-phenoxypyridin-3-yl)methyl-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium Openeye Name: (1-isopropylpiperidin-1-ium-4-yl)-[(2-phenoxy-3-pyridyl)methyl]ammonium CAS Name: (2-phenoxy-3-pyridinyl)methyl-(1-propan-2-yl-4-piperidin-1-iumyl)ammonium IUPAC Name: (2-phenoxypyridin-3-yl)methyl-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium Traditional Name: (1-isopropylpiperidin-1-ium-4-yl)-[(2-phenoxy-3-pyridyl)methyl]ammonium Formula: C20H29N3O+2 MolecularWeight: 327.46376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)[NH2+]CC2=C(N=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)[NH2+]CC2=C(N=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C20H27N3O/c1-16(2)23-13-10-18(11-14-23)22-15-17-7-6-12-21-20(17)24-19-8-4-3-5-9-19/h3-9,12,16,18,22H,10-11,13-15H2,1-2H3/p+2