2-[5-(3-chlorophenyl)-3-(1-thiophen-2-ylethyl)indol-1-yl]ethanoic acid

Systemtic Name: 2-[5-(3-chlorophenyl)-3-(1-thiophen-2-ylethyl)indol-1-yl]ethanoic acid Openeye Name: 2-[5-(3-chlorophenyl)-3-[1-(2-thienyl)ethyl]indol-1-yl]acetic acid CAS Name: 2-[5-(3-chlorophenyl)-3-(1-thiophen-2-ylethyl)-1-indolyl]acetic acid IUPAC Name: 2-[5-(3-chlorophenyl)-3-(1-thiophen-2-ylethyl)indol-1-yl]acetic acid Traditional Name: 2-[5-(3-chlorophenyl)-3-[1-(2-thienyl)ethyl]indol-1-yl]acetic acid Formula: C22H18ClNO2S MolecularWeight: 395.90182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)C2=CN(C3=C2C=C(C=C3)C4=CC(=CC=C4)Cl)CC(=O)O

Isomeric SMILES

CC(C1=CC=CS1)C2=CN(C3=C2C=C(C=C3)C4=CC(=CC=C4)Cl)CC(=O)O

InChI

InChI=1S/C22H18ClNO2S/c1-14(21-6-3-9-27-21)19-12-24(13-22(25)26)20-8-7-16(11-18(19)20)15-4-2-5-17(23)10-15/h2-12,14H,13H2,1H3,(H,25,26)