1-[[1-[6-[(3S)-3-methylpiperidin-1-yl]pyridin-1-ium-3-yl]carbonylpiperidin-4-yl]methyl]pyrrolidin-2-one

Systemtic Name: 1-[[1-[6-[(3S)-3-methylpiperidin-1-yl]pyridin-1-ium-3-yl]carbonylpiperidin-4-yl]methyl]pyrrolidin-2-one Openeye Name: 1-[[1-[6-[(3S)-3-methyl-1-piperidyl]pyridin-1-ium-3-carbonyl]-4-piperidyl]methyl]pyrrolidin-2-one CAS Name: 1-[[1-[[6-[(3S)-3-methyl-1-piperidinyl]-3-pyridin-1-iumyl]-oxomethyl]-4-piperidinyl]methyl]-2-pyrrolidinone IUPAC Name: 1-[[1-[6-[(3S)-3-methylpiperidin-1-yl]pyridin-1-ium-3-carbonyl]piperidin-4-yl]methyl]pyrrolidin-2-one Traditional Name: 1-[[1-[6-[(3S)-3-methylpiperidino]pyridin-1-ium-3-carbonyl]-4-piperidyl]methyl]-2-pyrrolidone Formula: C22H33N4O2+ MolecularWeight: 385.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=[NH+]C=C(C=C2)C(=O)N3CCC(CC3)CN4CCCC4=O

Isomeric SMILES

C[C@H]1CCCN(C1)C2=[NH+]C=C(C=C2)C(=O)N3CCC(CC3)CN4CCCC4=O

InChI

InChI=1S/C22H32N4O2/c1-17-4-2-10-25(15-17)20-7-6-19(14-23-20)22(28)24-12-8-18(9-13-24)16-26-11-3-5-21(26)27/h6-7,14,17-18H,2-5,8-13,15-16H2,1H3/p+1/t17-/m0/s1