(5R)-1-(2-methoxyethyl)-5-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]carbonyl-piperidin-2-one

Systemtic Name: (5R)-1-(2-methoxyethyl)-5-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-yl]carbonyl-piperidin-2-one Openeye Name: (5R)-1-(2-methoxyethyl)-5-[4-(3-pyridylmethyl)piperazin-4-ium-1-carbonyl]piperidin-2-one CAS Name: (5R)-1-(2-methoxyethyl)-5-[oxo-[4-(3-pyridinylmethyl)-1-piperazin-4-iumyl]methyl]-2-piperidinone IUPAC Name: (5R)-1-(2-methoxyethyl)-5-[4-(pyridin-3-ylmethyl)piperazin-4-ium-1-carbonyl]piperidin-2-one Traditional Name: (5R)-1-(2-methoxyethyl)-5-[4-(3-pyridylmethyl)piperazin-4-ium-1-carbonyl]-2-piperidone Formula: C19H29N4O3+ MolecularWeight: 361.45856

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1CC(CCC1=O)C(=O)N2CC[NH+](CC2)CC3=CN=CC=C3

Isomeric SMILES

COCCN1C[C@@H](CCC1=O)C(=O)N2CC[NH+](CC2)CC3=CN=CC=C3

InChI

InChI=1S/C19H28N4O3/c1-26-12-11-23-15-17(4-5-18(23)24)19(25)22-9-7-21(8-10-22)14-16-3-2-6-20-13-16/h2-3,6,13,17H,4-5,7-12,14-15H2,1H3/p+1/t17-/m1/s1