2-[2-methyl-1-[4-(thiophen-2-ylmethoxy)phenyl]carbonyl-indol-4-yl]ethanoic acid

Systemtic Name: 2-[2-methyl-1-[4-(thiophen-2-ylmethoxy)phenyl]carbonyl-indol-4-yl]ethanoic acid Openeye Name: 2-[2-methyl-1-[4-(2-thienylmethoxy)benzoyl]indol-4-yl]acetic acid CAS Name: 2-[2-methyl-1-[oxo-[4-(thiophen-2-ylmethoxy)phenyl]methyl]-4-indolyl]acetic acid IUPAC Name: 2-[2-methyl-1-[4-(thiophen-2-ylmethoxy)benzoyl]indol-4-yl]acetic acid Traditional Name: 2-[2-methyl-1-[4-(2-thenyloxy)benzoyl]indol-4-yl]acetic acid Formula: C23H19NO4S MolecularWeight: 405.46626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCC4=CC=CS4)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCC4=CC=CS4)CC(=O)O

InChI

InChI=1S/C23H19NO4S/c1-15-12-20-17(13-22(25)26)4-2-6-21(20)24(15)23(27)16-7-9-18(10-8-16)28-14-19-5-3-11-29-19/h2-12H,13-14H2,1H3,(H,25,26)