dimethyl-[2-[(5R)-2-oxidanylidene-5-(3-pyridin-3-ylpropylcarbamoyl)piperidin-1-yl]ethyl]azanium

Systemtic Name: dimethyl-[2-[(5R)-2-oxidanylidene-5-(3-pyridin-3-ylpropylcarbamoyl)piperidin-1-yl]ethyl]azanium Openeye Name: dimethyl-[2-[(5R)-2-oxo-5-[3-(3-pyridyl)propylcarbamoyl]-1-piperidyl]ethyl]ammonium CAS Name: dimethyl-[2-[(5R)-2-oxo-5-[oxo-[3-(3-pyridinyl)propylamino]methyl]-1-piperidinyl]ethyl]ammonium IUPAC Name: dimethyl-[2-[(5R)-2-oxo-5-(3-pyridin-3-ylpropylcarbamoyl)piperidin-1-yl]ethyl]azanium Traditional Name: 2-[(5R)-2-keto-5-[3-(3-pyridyl)propylcarbamoyl]piperidino]ethyl-dimethyl-ammonium Formula: C18H29N4O2+ MolecularWeight: 333.44846

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1CC(CCC1=O)C(=O)NCCCC2=CN=CC=C2

Isomeric SMILES

C[NH+](C)CCN1C[C@@H](CCC1=O)C(=O)NCCCC2=CN=CC=C2

InChI

InChI=1S/C18H28N4O2/c1-21(2)11-12-22-14-16(7-8-17(22)23)18(24)20-10-4-6-15-5-3-9-19-13-15/h3,5,9,13,16H,4,6-8,10-12,14H2,1-2H3,(H,20,24)/p+1/t16-/m1/s1