2-[4-[2-(5-methoxyindol-1-yl)ethoxy]phenyl]sulfanyl-2-methyl-propanoic acid

Systemtic Name: 2-[4-[2-(5-methoxyindol-1-yl)ethoxy]phenyl]sulfanyl-2-methyl-propanoic acid Openeye Name: 2-[4-[2-(5-methoxyindol-1-yl)ethoxy]phenyl]sulfanyl-2-methyl-propanoic acid CAS Name: 2-[[4-[2-(5-methoxy-1-indolyl)ethoxy]phenyl]thio]-2-methylpropanoic acid IUPAC Name: 2-[4-[2-(5-methoxyindol-1-yl)ethoxy]phenyl]sulfanyl-2-methylpropanoic acid Traditional Name: 2-[[4-[2-(5-methoxyindol-1-yl)ethoxy]phenyl]thio]-2-methyl-propionic acid Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)SC1=CC=C(C=C1)OCCN2C=CC3=C2C=CC(=C3)OC

Isomeric SMILES

CC(C)(C(=O)O)SC1=CC=C(C=C1)OCCN2C=CC3=C2C=CC(=C3)OC

InChI

InChI=1S/C21H23NO4S/c1-21(2,20(23)24)27-18-7-4-16(5-8-18)26-13-12-22-11-10-15-14-17(25-3)6-9-19(15)22/h4-11,14H,12-13H2,1-3H3,(H,23,24)