2-[2-(2-methylpropyl)-3-oxamoyl-1-(phenylmethyl)benzo[g]indol-4-yl]oxyethanoic acid

Systemtic Name: 2-[2-(2-methylpropyl)-3-oxamoyl-1-(phenylmethyl)benzo[g]indol-4-yl]oxyethanoic acid Openeye Name: 2-(1-benzyl-2-isobutyl-3-oxamoyl-benzo[g]indol-4-yl)oxyacetic acid CAS Name: 2-[[2-(2-methylpropyl)-3-oxamoyl-1-(phenylmethyl)-4-benzo[g]indolyl]oxy]acetic acid IUPAC Name: 2-[1-benzyl-2-(2-methylpropyl)-3-oxamoylbenzo[g]indol-4-yl]oxyacetic acid Traditional Name: 2-(1-benzyl-2-isobutyl-3-oxamoyl-benz[g]indol-4-yl)oxyacetic acid Formula: C27H26N2O5 MolecularWeight: 458.50574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C2=C(N1CC3=CC=CC=C3)C4=CC=CC=C4C=C2OCC(=O)O)C(=O)C(=O)N

Isomeric SMILES

CC(C)CC1=C(C2=C(N1CC3=CC=CC=C3)C4=CC=CC=C4C=C2OCC(=O)O)C(=O)C(=O)N

InChI

InChI=1S/C27H26N2O5/c1-16(2)12-20-23(26(32)27(28)33)24-21(34-15-22(30)31)13-18-10-6-7-11-19(18)25(24)29(20)14-17-8-4-3-5-9-17/h3-11,13,16H,12,14-15H2,1-2H3,(H2,28,33)(H,30,31)