(2R)-1-[1-(phenylmethyl)azetidin-3-yl]piperidin-1-ium-2-carboxylate

Systemtic Name: (2R)-1-[1-(phenylmethyl)azetidin-3-yl]piperidin-1-ium-2-carboxylate Openeye Name: (2R)-1-(1-benzylazetidin-3-yl)piperidin-1-ium-2-carboxylate CAS Name: (2R)-1-[1-(phenylmethyl)-3-azetidinyl]-2-piperidin-1-iumcarboxylate IUPAC Name: (2R)-1-(1-benzylazetidin-3-yl)piperidin-1-ium-2-carboxylate Traditional Name: (2R)-1-(1-benzylazetidin-3-yl)piperidin-1-ium-2-carboxylate Formula: C16H22N2O2 MolecularWeight: 274.35808

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)C(=O)[O-])C2CN(C2)CC3=CC=CC=C3

Isomeric SMILES

C1CC[NH+]([C@H](C1)C(=O)[O-])C2CN(C2)CC3=CC=CC=C3

InChI

InChI=1S/C16H22N2O2/c19-16(20)15-8-4-5-9-18(15)14-11-17(12-14)10-13-6-2-1-3-7-13/h1-3,6-7,14-15H,4-5,8-12H2,(H,19,20)/t15-/m1/s1