(3S)-3-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-1-(piperidin-1-ium-1-ylmethyl)indol-2-one

Systemtic Name: (3S)-3-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-1-(piperidin-1-ium-1-ylmethyl)indol-2-one Openeye Name: (3S)-3-hydroxy-3-[2-(3-nitrophenyl)-2-oxo-ethyl]-1-(piperidin-1-ium-1-ylmethyl)indolin-2-one CAS Name: (3S)-3-hydroxy-3-[2-(3-nitrophenyl)-2-oxoethyl]-1-(1-piperidin-1-iumylmethyl)-2-indolone IUPAC Name: (3S)-3-hydroxy-3-[2-(3-nitrophenyl)-2-oxoethyl]-1-(piperidin-1-ium-1-ylmethyl)indol-2-one Traditional Name: (3S)-3-hydroxy-3-[2-keto-2-(3-nitrophenyl)ethyl]-1-(piperidin-1-ium-1-ylmethyl)oxindole Formula: C22H24N3O5+ MolecularWeight: 410.44306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O5/c26-20(16-7-6-8-17(13-16)25(29)30)14-22(28)18-9-2-3-10-19(18)24(21(22)27)15-23-11-4-1-5-12-23/h2-3,6-10,13,28H,1,4-5,11-12,14-15H2/p+1/t22-/m0/s1