1-[[(3S)-1-(7-chloranyl-4-methyl-quinolin-1-ium-2-yl)piperidin-3-yl]methyl]pyrrolidin-2-one

Systemtic Name: 1-[[(3S)-1-(7-chloranyl-4-methyl-quinolin-1-ium-2-yl)piperidin-3-yl]methyl]pyrrolidin-2-one Openeye Name: 1-[[(3S)-1-(7-chloro-4-methyl-quinolin-1-ium-2-yl)-3-piperidyl]methyl]pyrrolidin-2-one CAS Name: 1-[[(3S)-1-(7-chloro-4-methyl-2-quinolin-1-iumyl)-3-piperidinyl]methyl]-2-pyrrolidinone IUPAC Name: 1-[[(3S)-1-(7-chloro-4-methylquinolin-1-ium-2-yl)piperidin-3-yl]methyl]pyrrolidin-2-one Traditional Name: 1-[[(3S)-1-(7-chloro-4-methyl-quinolin-1-ium-2-yl)-3-piperidyl]methyl]-2-pyrrolidone Formula: C20H25ClN3O+ MolecularWeight: 358.885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=C1C=CC(=C2)Cl)N3CCCC(C3)CN4CCCC4=O

Isomeric SMILES

CC1=CC(=[NH+]C2=C1C=CC(=C2)Cl)N3CCC[C@@H](C3)CN4CCCC4=O

InChI

InChI=1S/C20H24ClN3O/c1-14-10-19(22-18-11-16(21)6-7-17(14)18)23-8-2-4-15(12-23)13-24-9-3-5-20(24)25/h6-7,10-11,15H,2-5,8-9,12-13H2,1H3/p+1/t15-/m0/s1