(3R)-1-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[2-(4-benzylpiperidino)-2-keto-ethyl]piperidin-1-ium-3-carboxamide Formula: C20H30N3O2+ MolecularWeight: 344.4711

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC(=O)N2CCC(CC2)CC3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1C[C@H](C[NH+](C1)CC(=O)N2CCC(CC2)CC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C20H29N3O2/c21-20(25)18-7-4-10-22(14-18)15-19(24)23-11-8-17(9-12-23)13-16-5-2-1-3-6-16/h1-3,5-6,17-18H,4,7-15H2,(H2,21,25)/p+1/t18-/m1/s1