6-[2-(4-ethylthiophen-2-yl)-3-methyl-5-oxidanyl-indol-1-yl]hexanoic acid

Systemtic Name: 6-[2-(4-ethylthiophen-2-yl)-3-methyl-5-oxidanyl-indol-1-yl]hexanoic acid Openeye Name: 6-[2-(4-ethyl-2-thienyl)-5-hydroxy-3-methyl-indol-1-yl]hexanoic acid CAS Name: 6-[2-(4-ethyl-2-thiophenyl)-5-hydroxy-3-methyl-1-indolyl]hexanoic acid IUPAC Name: 6-[2-(4-ethylthiophen-2-yl)-5-hydroxy-3-methylindol-1-yl]hexanoic acid Traditional Name: 6-[2-(4-ethyl-2-thienyl)-5-hydroxy-3-methyl-indol-1-yl]hexanoic acid Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CSC(=C1)C2=C(C3=C(N2CCCCCC(=O)O)C=CC(=C3)O)C

Isomeric SMILES

CCC1=CSC(=C1)C2=C(C3=C(N2CCCCCC(=O)O)C=CC(=C3)O)C

InChI

InChI=1S/C21H25NO3S/c1-3-15-11-19(26-13-15)21-14(2)17-12-16(23)8-9-18(17)22(21)10-6-4-5-7-20(24)25/h8-9,11-13,23H,3-7,10H2,1-2H3,(H,24,25)