3-methyl-2-[2-methyl-1-[12-[2-[12-[2-methyl-4-(3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)oxy-3-oxamoyl-indol-1-yl]dodecoxy]phenoxy]dodecyl]-3-oxamoyl-indol-4-yl]oxy-butanoic acid

Systemtic Name: 3-methyl-2-[2-methyl-1-[12-[2-[12-[2-methyl-4-(3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)oxy-3-oxamoyl-indol-1-yl]dodecoxy]phenoxy]dodecyl]-3-oxamoyl-indol-4-yl]oxy-butanoic acid Openeye Name: 2-[1-[12-[2-[12-[4-(1-carboxy-2-methyl-propoxy)-2-methyl-3-oxamoyl-indol-1-yl]dodecoxy]phenoxy]dodecyl]-2-methyl-3-oxamoyl-indol-4-yl]oxy-3-methyl-butanoic acid CAS Name: 2-[[1-[12-[2-[12-[4-(1-hydroxy-3-methyl-1-oxobutan-2-yl)oxy-2-methyl-3-oxamoyl-1-indolyl]dodecoxy]phenoxy]dodecyl]-2-methyl-3-oxamoyl-4-indolyl]oxy]-3-methylbutanoic acid IUPAC Name: 2-[1-[12-[2-[12-[4-(1-hydroxy-3-methyl-1-oxobutan-2-yl)oxy-2-methyl-3-oxamoylindol-1-yl]dodecoxy]phenoxy]dodecyl]-2-methyl-3-oxamoylindol-4-yl]oxy-3-methylbutanoic acid Traditional Name: 2-[1-[12-[2-[12-[4-(1-carboxy-2-methyl-propoxy)-2-methyl-3-oxamoyl-indol-1-yl]dodecoxy]phenoxy]dodecyl]-2-methyl-3-oxamoyl-indol-4-yl]oxy-3-methyl-butyric acid Formula: C62H86N4O12 MolecularWeight: 1079.36584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CCCCCCCCCCCCOC3=CC=CC=C3OCCCCCCCCCCCCN4C(=C(C5=C4C=CC=C5OC(C(C)C)C(=O)O)C(=O)C(=O)N)C)C=CC=C2OC(C(C)C)C(=O)O)C(=O)C(=O)N

Isomeric SMILES

CC1=C(C2=C(N1CCCCCCCCCCCCOC3=CC=CC=C3OCCCCCCCCCCCCN4C(=C(C5=C4C=CC=C5OC(C(C)C)C(=O)O)C(=O)C(=O)N)C)C=CC=C2OC(C(C)C)C(=O)O)C(=O)C(=O)N

InChI

InChI=1S/C62H86N4O12/c1-41(2)57(61(71)72)77-49-35-29-31-45-53(49)51(55(67)59(63)69)43(5)65(45)37-25-19-15-11-7-9-13-17-21-27-39-75-47-33-23-24-34-48(47)76-40-28-22-18-14-10-8-12-16-20-26-38-66-44(6)52(56(68)60(64)70)54-46(66)32-30-36-50(54)78-58(42(3)4)62(73)74/h23-24,29-36,41-42,57-58H,7-22,25-28,37-40H2,1-6H3,(H2,63,69)(H2,64,70)(H,71,72)(H,73,74)