4-[2-[2-[2-[[5,6-bis(chloranyl)pyridin-2-yl]methylsulfonylamino]ethyl]-5-chloranyl-1-(diphenylmethyl)indol-3-yl]ethoxy]benzoic acid

Systemtic Name: 4-[2-[2-[2-[[5,6-bis(chloranyl)pyridin-2-yl]methylsulfonylamino]ethyl]-5-chloranyl-1-(diphenylmethyl)indol-3-yl]ethoxy]benzoic acid Openeye Name: 4-[2-[1-benzhydryl-5-chloro-2-[2-[(5,6-dichloro-2-pyridyl)methylsulfonylamino]ethyl]indol-3-yl]ethoxy]benzoic acid CAS Name: 4-[2-[5-chloro-2-[2-[(5,6-dichloro-2-pyridinyl)methylsulfonylamino]ethyl]-1-(diphenylmethyl)-3-indolyl]ethoxy]benzoic acid IUPAC Name: 4-[2-[1-benzhydryl-5-chloro-2-[2-[(5,6-dichloropyridin-2-yl)methylsulfonylamino]ethyl]indol-3-yl]ethoxy]benzoic acid Traditional Name: 4-[2-[1-benzhydryl-5-chloro-2-[2-[(5,6-dichloro-2-pyridyl)methylsulfonylamino]ethyl]indol-3-yl]ethoxy]benzoic acid Formula: C38H32Cl3N3O5S MolecularWeight: 749.10178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)N3C4=C(C=C(C=C4)Cl)C(=C3CCNS(=O)(=O)CC5=NC(=C(C=C5)Cl)Cl)CCOC6=CC=C(C=C6)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)N3C4=C(C=C(C=C4)Cl)C(=C3CCNS(=O)(=O)CC5=NC(=C(C=C5)Cl)Cl)CCOC6=CC=C(C=C6)C(=O)O

InChI

InChI=1S/C38H32Cl3N3O5S/c39-28-13-18-34-32(23-28)31(20-22-49-30-15-11-27(12-16-30)38(45)46)35(19-21-42-50(47,48)24-29-14-17-33(40)37(41)43-29)44(34)36(25-7-3-1-4-8-25)26-9-5-2-6-10-26/h1-18,23,36,42H,19-22,24H2,(H,45,46)