3-chloranyl-4-[1-methyl-3-(phenylmethyl)indol-5-yl]oxy-benzoic acid

Systemtic Name: 3-chloranyl-4-[1-methyl-3-(phenylmethyl)indol-5-yl]oxy-benzoic acid Openeye Name: 4-(3-benzyl-1-methyl-indol-5-yl)oxy-3-chloro-benzoic acid CAS Name: 3-chloro-4-[[1-methyl-3-(phenylmethyl)-5-indolyl]oxy]benzoic acid IUPAC Name: 4-(3-benzyl-1-methylindol-5-yl)oxy-3-chlorobenzoic acid Traditional Name: 4-(3-benzyl-1-methyl-indol-5-yl)oxy-3-chloro-benzoic acid Formula: C23H18ClNO3 MolecularWeight: 391.84692

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)OC3=C(C=C(C=C3)C(=O)O)Cl)CC4=CC=CC=C4

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)OC3=C(C=C(C=C3)C(=O)O)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C23H18ClNO3/c1-25-14-17(11-15-5-3-2-4-6-15)19-13-18(8-9-21(19)25)28-22-10-7-16(23(26)27)12-20(22)24/h2-10,12-14H,11H2,1H3,(H,26,27)