(5S)-1-cyclopropyl-5-[4-(2,6-dimethylpyridin-1-ium-4-yl)piperazin-1-yl]carbonyl-piperidin-2-one

Systemtic Name: (5S)-1-cyclopropyl-5-[4-(2,6-dimethylpyridin-1-ium-4-yl)piperazin-1-yl]carbonyl-piperidin-2-one Openeye Name: (5S)-1-cyclopropyl-5-[4-(2,6-dimethylpyridin-1-ium-4-yl)piperazine-1-carbonyl]piperidin-2-one CAS Name: (5S)-1-cyclopropyl-5-[[4-(2,6-dimethyl-4-pyridin-1-iumyl)-1-piperazinyl]-oxomethyl]-2-piperidinone IUPAC Name: (5S)-1-cyclopropyl-5-[4-(2,6-dimethylpyridin-1-ium-4-yl)piperazine-1-carbonyl]piperidin-2-one Traditional Name: (5S)-1-cyclopropyl-5-[4-(2,6-dimethylpyridin-1-ium-4-yl)piperazine-1-carbonyl]-2-piperidone Formula: C20H29N4O2+ MolecularWeight: 357.46986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=[NH+]1)C)N2CCN(CC2)C(=O)C3CCC(=O)N(C3)C4CC4

Isomeric SMILES

CC1=CC(=CC(=[NH+]1)C)N2CCN(CC2)C(=O)[C@H]3CCC(=O)N(C3)C4CC4

InChI

InChI=1S/C20H28N4O2/c1-14-11-18(12-15(2)21-14)22-7-9-23(10-8-22)20(26)16-3-6-19(25)24(13-16)17-4-5-17/h11-12,16-17H,3-10,13H2,1-2H3/p+1/t16-/m0/s1