3-(3-chloranyl-4-methyl-phenyl)imino-1-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]indol-2-one

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)imino-1-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]indol-2-one Openeye Name: 3-(3-chloro-4-methyl-phenyl)imino-1-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]indolin-2-one CAS Name: 3-(3-chloro-4-methylphenyl)imino-1-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-2-indolone IUPAC Name: 3-(3-chloro-4-methylphenyl)imino-1-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]indol-2-one Traditional Name: 3-(3-chloro-4-methyl-phenyl)imino-1-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]oxindole Formula: C22H25ClN3O+ MolecularWeight: 382.9064

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CN2C3=CC=CC=C3C(=NC4=CC(=C(C=C4)C)Cl)C2=O

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CN2C3=CC=CC=C3C(=NC4=CC(=C(C=C4)C)Cl)C2=O

InChI

InChI=1S/C22H24ClN3O/c1-15-6-5-11-25(13-15)14-26-20-8-4-3-7-18(20)21(22(26)27)24-17-10-9-16(2)19(23)12-17/h3-4,7-10,12,15H,5-6,11,13-14H2,1-2H3/p+1/t15-/m0/s1