4-[3-[5-chloranyl-2-[2-[(3,4-dichlorophenyl)sulfonylamino]ethyl]-1-(diphenylmethyl)indol-3-yl]propyl]benzoic acid

Systemtic Name: 4-[3-[5-chloranyl-2-[2-[(3,4-dichlorophenyl)sulfonylamino]ethyl]-1-(diphenylmethyl)indol-3-yl]propyl]benzoic acid Openeye Name: 4-[3-[1-benzhydryl-5-chloro-2-[2-[(3,4-dichlorophenyl)sulfonylamino]ethyl]indol-3-yl]propyl]benzoic acid CAS Name: 4-[3-[5-chloro-2-[2-[(3,4-dichlorophenyl)sulfonylamino]ethyl]-1-(diphenylmethyl)-3-indolyl]propyl]benzoic acid IUPAC Name: 4-[3-[1-benzhydryl-5-chloro-2-[2-[(3,4-dichlorophenyl)sulfonylamino]ethyl]indol-3-yl]propyl]benzoic acid Traditional Name: 4-[3-[1-benzhydryl-5-chloro-2-[2-[(3,4-dichlorophenyl)sulfonylamino]ethyl]indol-3-yl]propyl]benzoic acid Formula: C39H33Cl3N2O4S MolecularWeight: 732.11432

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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)C5=CC(=C(C=C5)Cl)Cl)CCCC6=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)C5=CC(=C(C=C5)Cl)Cl)CCCC6=CC=C(C=C6)C(=O)O

InChI

InChI=1S/C39H33Cl3N2O4S/c40-30-18-21-36-33(24-30)32(13-7-8-26-14-16-29(17-15-26)39(45)46)37(22-23-43-49(47,48)31-19-20-34(41)35(42)25-31)44(36)38(27-9-3-1-4-10-27)28-11-5-2-6-12-28/h1-6,9-12,14-21,24-25,38,43H,7-8,13,22-23H2,(H,45,46)