2-[1-(4-chlorophenyl)carbonyl-2-methyl-5-[3-oxidanylidene-3-(1-phenylethoxy)propoxy]carbonyl-indol-3-yl]ethanoic acid

Systemtic Name: 2-[1-(4-chlorophenyl)carbonyl-2-methyl-5-[3-oxidanylidene-3-(1-phenylethoxy)propoxy]carbonyl-indol-3-yl]ethanoic acid Openeye Name: 2-[1-(4-chlorobenzoyl)-2-methyl-5-[3-oxo-3-(1-phenylethoxy)propoxy]carbonyl-indol-3-yl]acetic acid CAS Name: 2-[1-[(4-chlorophenyl)-oxomethyl]-2-methyl-5-[oxo-[3-oxo-3-(1-phenylethoxy)propoxy]methyl]-3-indolyl]acetic acid IUPAC Name: 2-[1-(4-chlorobenzoyl)-2-methyl-5-[3-oxo-3-(1-phenylethoxy)propoxy]carbonylindol-3-yl]acetic acid Traditional Name: 2-[1-(4-chlorobenzoyl)-5-[3-keto-3-(1-phenylethoxy)propoxy]carbonyl-2-methyl-indol-3-yl]acetic acid Formula: C30H26ClNO7 MolecularWeight: 547.98294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)C(=O)OCCC(=O)OC(C)C4=CC=CC=C4)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)C(=O)OCCC(=O)OC(C)C4=CC=CC=C4)CC(=O)O

InChI

InChI=1S/C30H26ClNO7/c1-18-24(17-27(33)34)25-16-22(10-13-26(25)32(18)29(36)21-8-11-23(31)12-9-21)30(37)38-15-14-28(35)39-19(2)20-6-4-3-5-7-20/h3-13,16,19H,14-15,17H2,1-2H3,(H,33,34)