3-[4-[(5-chloranylthiophen-2-yl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid

Systemtic Name: 3-[4-[(5-chloranylthiophen-2-yl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid Openeye Name: 3-[4-[(5-chloro-2-thienyl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid CAS Name: 3-[4-[(5-chloro-2-thiophenyl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid IUPAC Name: 3-[4-[(5-chlorothiophen-2-yl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid Traditional Name: 3-[4-[(5-chloro-2-thienyl)methoxy]-3-(1H-indol-5-yl)phenyl]propionic acid Formula: C22H18ClNO3S MolecularWeight: 411.90122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CCC(=O)O)C2=CC3=C(C=C2)NC=C3)OCC4=CC=C(S4)Cl

Isomeric SMILES

C1=CC(=C(C=C1CCC(=O)O)C2=CC3=C(C=C2)NC=C3)OCC4=CC=C(S4)Cl

InChI

InChI=1S/C22H18ClNO3S/c23-21-7-4-17(28-21)13-27-20-6-1-14(2-8-22(25)26)11-18(20)15-3-5-19-16(12-15)9-10-24-19/h1,3-7,9-12,24H,2,8,13H2,(H,25,26)