(3R)-3-[2-(2,4-dimethylfuran-3-yl)-2-oxidanylidene-ethyl]-3-oxidanyl-1-(piperidin-1-ium-1-ylmethyl)indol-2-one

Systemtic Name: (3R)-3-[2-(2,4-dimethylfuran-3-yl)-2-oxidanylidene-ethyl]-3-oxidanyl-1-(piperidin-1-ium-1-ylmethyl)indol-2-one Openeye Name: (3R)-3-[2-(2,4-dimethyl-3-furyl)-2-oxo-ethyl]-3-hydroxy-1-(piperidin-1-ium-1-ylmethyl)indolin-2-one CAS Name: (3R)-3-[2-(2,4-dimethyl-3-furanyl)-2-oxoethyl]-3-hydroxy-1-(1-piperidin-1-iumylmethyl)-2-indolone IUPAC Name: (3R)-3-[2-(2,4-dimethylfuran-3-yl)-2-oxoethyl]-3-hydroxy-1-(piperidin-1-ium-1-ylmethyl)indol-2-one Traditional Name: (3R)-3-[2-(2,4-dimethyl-3-furyl)-2-keto-ethyl]-3-hydroxy-1-(piperidin-1-ium-1-ylmethyl)oxindole Formula: C22H27N2O4+ MolecularWeight: 383.46078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC(=C1C(=O)CC2(C3=CC=CC=C3N(C2=O)C[NH+]4CCCCC4)O)C

Isomeric SMILES

CC1=COC(=C1C(=O)C[C@]2(C3=CC=CC=C3N(C2=O)C[NH+]4CCCCC4)O)C

InChI

InChI=1S/C22H26N2O4/c1-15-13-28-16(2)20(15)19(25)12-22(27)17-8-4-5-9-18(17)24(21(22)26)14-23-10-6-3-7-11-23/h4-5,8-9,13,27H,3,6-7,10-12,14H2,1-2H3/p+1/t22-/m1/s1