3-(1H-indol-3-yl)-2-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]disulfanyl]propanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]disulfanyl]propanoic acid Openeye Name: 2-[[2-hydroxy-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]disulfanyl]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]disulfanyl]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[[1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]disulfanyl]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[[2-hydroxy-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]disulfanyl]-3-(1H-indol-3-yl)propionic acid Formula: C22H20N2O4S2 MolecularWeight: 440.5352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)SSC(CC3=CNC4=CC=CC=C43)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)SSC(CC3=CNC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C22H20N2O4S2/c25-21(26)19(9-13-11-23-17-7-3-1-5-15(13)17)29-30-20(22(27)28)10-14-12-24-18-8-4-2-6-16(14)18/h1-8,11-12,19-20,23-24H,9-10H2,(H,25,26)(H,27,28)