2-[3-(4-methoxyphenyl)sulfanyl-2,5-dimethyl-indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(4-methoxyphenyl)sulfanyl-2,5-dimethyl-indol-1-yl]ethanoic acid Openeye Name: 2-[3-(4-methoxyphenyl)sulfanyl-2,5-dimethyl-indol-1-yl]acetic acid CAS Name: 2-[3-[(4-methoxyphenyl)thio]-2,5-dimethyl-1-indolyl]acetic acid IUPAC Name: 2-[3-(4-methoxyphenyl)sulfanyl-2,5-dimethylindol-1-yl]acetic acid Traditional Name: 2-[3-[(4-methoxyphenyl)thio]-2,5-dimethyl-indol-1-yl]acetic acid Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2SC3=CC=C(C=C3)OC)C)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2SC3=CC=C(C=C3)OC)C)CC(=O)O

InChI

InChI=1S/C19H19NO3S/c1-12-4-9-17-16(10-12)19(13(2)20(17)11-18(21)22)24-15-7-5-14(23-3)6-8-15/h4-10H,11H2,1-3H3,(H,21,22)