3-chloranyl-4-(1-octylindol-5-yl)oxy-benzoic acid

Systemtic Name: 3-chloranyl-4-(1-octylindol-5-yl)oxy-benzoic acid Openeye Name: 3-chloro-4-(1-octylindol-5-yl)oxy-benzoic acid CAS Name: 3-chloro-4-[(1-octyl-5-indolyl)oxy]benzoic acid IUPAC Name: 3-chloro-4-(1-octylindol-5-yl)oxybenzoic acid Traditional Name: 3-chloro-4-(1-octylindol-5-yl)oxy-benzoic acid Formula: C23H26ClNO3 MolecularWeight: 399.91044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C=CC2=C1C=CC(=C2)OC3=C(C=C(C=C3)C(=O)O)Cl

Isomeric SMILES

CCCCCCCCN1C=CC2=C1C=CC(=C2)OC3=C(C=C(C=C3)C(=O)O)Cl

InChI

InChI=1S/C23H26ClNO3/c1-2-3-4-5-6-7-13-25-14-12-17-15-19(9-10-21(17)25)28-22-11-8-18(23(26)27)16-20(22)24/h8-12,14-16H,2-7,13H2,1H3,(H,26,27)