(3S)-3-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]-5-bromanyl-3-oxidanyl-1-(thiophen-2-ylmethyl)indol-2-one

Systemtic Name: (3S)-3-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]-5-bromanyl-3-oxidanyl-1-(thiophen-2-ylmethyl)indol-2-one Openeye Name: (3S)-3-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl]-5-bromo-3-hydroxy-1-(2-thienylmethyl)indolin-2-one CAS Name: (3S)-3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-5-bromo-3-hydroxy-1-(thiophen-2-ylmethyl)-2-indolone IUPAC Name: (3S)-3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-5-bromo-3-hydroxy-1-(thiophen-2-ylmethyl)indol-2-one Traditional Name: (3S)-3-[2-(1,3-benzodioxol-5-yl)-2-keto-ethyl]-5-bromo-3-hydroxy-1-(2-thenyl)oxindole Formula: C22H16BrNO5S MolecularWeight: 486.33514

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)CC3(C4=C(C=CC(=C4)Br)N(C3=O)CC5=CC=CS5)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)C[C@@]3(C4=C(C=CC(=C4)Br)N(C3=O)CC5=CC=CS5)O

InChI

InChI=1S/C22H16BrNO5S/c23-14-4-5-17-16(9-14)22(27,21(26)24(17)11-15-2-1-7-30-15)10-18(25)13-3-6-19-20(8-13)29-12-28-19/h1-9,27H,10-12H2/t22-/m0/s1