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

Systemtic Name: 3-chloranyl-4-[1-[(4-propylphenyl)methyl]indol-5-yl]oxy-benzoic acid Openeye Name: 3-chloro-4-[1-[(4-propylphenyl)methyl]indol-5-yl]oxy-benzoic acid CAS Name: 3-chloro-4-[[1-[(4-propylphenyl)methyl]-5-indolyl]oxy]benzoic acid IUPAC Name: 3-chloro-4-[1-[(4-propylphenyl)methyl]indol-5-yl]oxybenzoic acid Traditional Name: 3-chloro-4-[1-(4-propylbenzyl)indol-5-yl]oxy-benzoic acid Formula: C25H22ClNO3 MolecularWeight: 419.90008

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)CN2C=CC3=C2C=CC(=C3)OC4=C(C=C(C=C4)C(=O)O)Cl

Isomeric SMILES

CCCC1=CC=C(C=C1)CN2C=CC3=C2C=CC(=C3)OC4=C(C=C(C=C4)C(=O)O)Cl

InChI

InChI=1S/C25H22ClNO3/c1-2-3-17-4-6-18(7-5-17)16-27-13-12-19-14-21(9-10-23(19)27)30-24-11-8-20(25(28)29)15-22(24)26/h4-15H,2-3,16H2,1H3,(H,28,29)