2-([1,3]dioxolo[4,5-f]indol-5-ylmethylsulfanyl)ethanoic acid

Systemtic Name: 2-([1,3]dioxolo[4,5-f]indol-5-ylmethylsulfanyl)ethanoic acid Openeye Name: 2-([1,3]dioxolo[4,5-f]indol-5-ylmethylsulfanyl)acetic acid CAS Name: 2-([1,3]dioxolo[4,5-f]indol-5-ylmethylthio)acetic acid IUPAC Name: 2-([1,3]dioxolo[4,5-f]indol-5-ylmethylsulfanyl)acetic acid Traditional Name: 2-([1,3]dioxol[4,5-f]indol-5-ylmethylthio)acetic acid Formula: C12H11NO4S MolecularWeight: 265.28504

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C3C(=C2)C=CN3CSCC(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C3C(=C2)C=CN3CSCC(=O)O

InChI

InChI=1S/C12H11NO4S/c14-12(15)5-18-6-13-2-1-8-3-10-11(4-9(8)13)17-7-16-10/h1-4H,5-7H2,(H,14,15)