3-chloranyl-4-[1-(3-methylbut-2-enyl)indol-5-yl]oxy-benzoic acid

Systemtic Name: 3-chloranyl-4-[1-(3-methylbut-2-enyl)indol-5-yl]oxy-benzoic acid Openeye Name: 3-chloro-4-[1-(3-methylbut-2-enyl)indol-5-yl]oxy-benzoic acid CAS Name: 3-chloro-4-[[1-(3-methylbut-2-enyl)-5-indolyl]oxy]benzoic acid IUPAC Name: 3-chloro-4-[1-(3-methylbut-2-enyl)indol-5-yl]oxybenzoic acid Traditional Name: 3-chloro-4-[1-(3-methylbut-2-enyl)indol-5-yl]oxy-benzoic acid Formula: C20H18ClNO3 MolecularWeight: 355.81482

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C=CC2=C1C=CC(=C2)OC3=C(C=C(C=C3)C(=O)O)Cl)C

Isomeric SMILES

CC(=CCN1C=CC2=C1C=CC(=C2)OC3=C(C=C(C=C3)C(=O)O)Cl)C

InChI

InChI=1S/C20H18ClNO3/c1-13(2)7-9-22-10-8-14-11-16(4-5-18(14)22)25-19-6-3-15(20(23)24)12-17(19)21/h3-8,10-12H,9H2,1-2H3,(H,23,24)