(3S)-3-[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl]-1-(morpholin-4-ium-4-ylmethyl)-3-oxidanyl-indol-2-one

Systemtic Name: (3S)-3-[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl]-1-(morpholin-4-ium-4-ylmethyl)-3-oxidanyl-indol-2-one Openeye Name: (3S)-3-[2-(5-bromo-2-thienyl)-2-oxo-ethyl]-3-hydroxy-1-(morpholin-4-ium-4-ylmethyl)indolin-2-one CAS Name: (3S)-3-[2-(5-bromo-2-thiophenyl)-2-oxoethyl]-3-hydroxy-1-(4-morpholin-4-iumylmethyl)-2-indolone IUPAC Name: (3S)-3-[2-(5-bromothiophen-2-yl)-2-oxoethyl]-3-hydroxy-1-(morpholin-4-ium-4-ylmethyl)indol-2-one Traditional Name: (3S)-3-[2-(5-bromo-2-thienyl)-2-keto-ethyl]-3-hydroxy-1-(morpholin-4-ium-4-ylmethyl)oxindole Formula: C19H20BrN2O4S+ MolecularWeight: 452.3421

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CN2C3=CC=CC=C3C(C2=O)(CC(=O)C4=CC=C(S4)Br)O

Isomeric SMILES

C1COCC[NH+]1CN2C3=CC=CC=C3[C@](C2=O)(CC(=O)C4=CC=C(S4)Br)O

InChI

InChI=1S/C19H19BrN2O4S/c20-17-6-5-16(27-17)15(23)11-19(25)13-3-1-2-4-14(13)22(18(19)24)12-21-7-9-26-10-8-21/h1-6,25H,7-12H2/p+1/t19-/m0/s1