(3R)-1-(azepan-1-ium-1-ylmethyl)-3-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-indol-2-one

Systemtic Name: (3R)-1-(azepan-1-ium-1-ylmethyl)-3-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]-3-oxidanyl-indol-2-one Openeye Name: (3R)-1-(azepan-1-ium-1-ylmethyl)-3-[2-(4-fluorophenyl)-2-oxo-ethyl]-3-hydroxy-indolin-2-one CAS Name: (3R)-1-(1-azepan-1-iumylmethyl)-3-[2-(4-fluorophenyl)-2-oxoethyl]-3-hydroxy-2-indolone IUPAC Name: (3R)-1-(azepan-1-ium-1-ylmethyl)-3-[2-(4-fluorophenyl)-2-oxoethyl]-3-hydroxyindol-2-one Traditional Name: (3R)-1-(azepan-1-ium-1-ylmethyl)-3-[2-(4-fluorophenyl)-2-keto-ethyl]-3-hydroxy-oxindole Formula: C23H26FN2O3+ MolecularWeight: 397.462543

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CN2C3=CC=CC=C3C(C2=O)(CC(=O)C4=CC=C(C=C4)F)O

Isomeric SMILES

C1CCC[NH+](CC1)CN2C3=CC=CC=C3[C@@](C2=O)(CC(=O)C4=CC=C(C=C4)F)O

InChI

InChI=1S/C23H25FN2O3/c24-18-11-9-17(10-12-18)21(27)15-23(29)19-7-3-4-8-20(19)26(22(23)28)16-25-13-5-1-2-6-14-25/h3-4,7-12,29H,1-2,5-6,13-16H2/p+1/t23-/m1/s1