(3S)-3-oxidanyl-3-phenacyl-1-(piperidin-1-ium-1-ylmethyl)indol-2-one

Systemtic Name: (3S)-3-oxidanyl-3-phenacyl-1-(piperidin-1-ium-1-ylmethyl)indol-2-one Openeye Name: (3S)-3-hydroxy-3-phenacyl-1-(piperidin-1-ium-1-ylmethyl)indolin-2-one CAS Name: (3S)-3-hydroxy-3-phenacyl-1-(1-piperidin-1-iumylmethyl)-2-indolone IUPAC Name: (3S)-3-hydroxy-3-phenacyl-1-(piperidin-1-ium-1-ylmethyl)indol-2-one Traditional Name: (3S)-3-hydroxy-3-phenacyl-1-(piperidin-1-ium-1-ylmethyl)oxindole Formula: C22H25N2O3+ MolecularWeight: 365.4455

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CN2C3=CC=CC=C3C(C2=O)(CC(=O)C4=CC=CC=C4)O

Isomeric SMILES

C1CC[NH+](CC1)CN2C3=CC=CC=C3[C@](C2=O)(CC(=O)C4=CC=CC=C4)O

InChI

InChI=1S/C22H24N2O3/c25-20(17-9-3-1-4-10-17)15-22(27)18-11-5-6-12-19(18)24(21(22)26)16-23-13-7-2-8-14-23/h1,3-6,9-12,27H,2,7-8,13-16H2/p+1/t22-/m0/s1