6-chloranyl-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-2-phenyl-1H-quinolin-4-one

Systemtic Name: 6-chloranyl-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-2-phenyl-1H-quinolin-4-one Openeye Name: 6-chloro-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-2-phenyl-1H-quinolin-4-one CAS Name: 6-chloro-3-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-2-phenyl-1H-quinolin-4-one IUPAC Name: 6-chloro-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-2-phenyl-1H-quinolin-4-one Traditional Name: 6-chloro-3-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-2-phenyl-4-quinolone Formula: C22H24ClN2O+ MolecularWeight: 367.89176

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=C(NC3=C(C2=O)C=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=C(NC3=C(C2=O)C=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H23ClN2O/c1-15-6-5-11-25(13-15)14-19-21(16-7-3-2-4-8-16)24-20-10-9-17(23)12-18(20)22(19)26/h2-4,7-10,12,15H,5-6,11,13-14H2,1H3,(H,24,26)/p+1/t15-/m0/s1