2-[(5-oxidanyl-1H-indol-2-yl)sulfanyl]-2-phenyl-propanoic acid

Systemtic Name: 2-[(5-oxidanyl-1H-indol-2-yl)sulfanyl]-2-phenyl-propanoic acid Openeye Name: 2-[(5-hydroxy-1H-indol-2-yl)sulfanyl]-2-phenyl-propanoic acid CAS Name: 2-[(5-hydroxy-1H-indol-2-yl)thio]-2-phenylpropanoic acid IUPAC Name: 2-[(5-hydroxy-1H-indol-2-yl)sulfanyl]-2-phenylpropanoic acid Traditional Name: 2-[(5-hydroxy-1H-indol-2-yl)thio]-2-phenyl-propionic acid Formula: C17H15NO3S MolecularWeight: 313.3709

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)(C(=O)O)SC2=CC3=C(N2)C=CC(=C3)O

Isomeric SMILES

CC(C1=CC=CC=C1)(C(=O)O)SC2=CC3=C(N2)C=CC(=C3)O

InChI

InChI=1S/C17H15NO3S/c1-17(16(20)21,12-5-3-2-4-6-12)22-15-10-11-9-13(19)7-8-14(11)18-15/h2-10,18-19H,1H3,(H,20,21)