(2R)-1-(cyclopropylmethyl)-N-(6-phenoxypyridin-3-yl)piperidin-1-ium-2-carboxamide

Systemtic Name: (2R)-1-(cyclopropylmethyl)-N-(6-phenoxypyridin-3-yl)piperidin-1-ium-2-carboxamide Openeye Name: (2R)-1-(cyclopropylmethyl)-N-(6-phenoxy-3-pyridyl)piperidin-1-ium-2-carboxamide CAS Name: (2R)-1-(cyclopropylmethyl)-N-(6-phenoxy-3-pyridinyl)-2-piperidin-1-iumcarboxamide IUPAC Name: (2R)-1-(cyclopropylmethyl)-N-(6-phenoxypyridin-3-yl)piperidin-1-ium-2-carboxamide Traditional Name: (2R)-1-(cyclopropylmethyl)-N-(6-phenoxy-3-pyridyl)piperidin-1-ium-2-carboxamide Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)C(=O)NC2=CN=C(C=C2)OC3=CC=CC=C3)CC4CC4

Isomeric SMILES

C1CC[NH+]([C@H](C1)C(=O)NC2=CN=C(C=C2)OC3=CC=CC=C3)CC4CC4

InChI

InChI=1S/C21H25N3O2/c25-21(19-8-4-5-13-24(19)15-16-9-10-16)23-17-11-12-20(22-14-17)26-18-6-2-1-3-7-18/h1-3,6-7,11-12,14,16,19H,4-5,8-10,13,15H2,(H,23,25)/p+1/t19-/m1/s1