tert-butyl 4-[2-ethyl-3-oxamoyl-1-(phenylmethyl)indol-5-yl]oxybutanoate

Systemtic Name: tert-butyl 4-[2-ethyl-3-oxamoyl-1-(phenylmethyl)indol-5-yl]oxybutanoate Openeye Name: tert-butyl 4-(1-benzyl-2-ethyl-3-oxamoyl-indol-5-yl)oxybutanoate CAS Name: 4-[[2-ethyl-3-oxamoyl-1-(phenylmethyl)-5-indolyl]oxy]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1-benzyl-2-ethyl-3-oxamoylindol-5-yl)oxybutanoate Traditional Name: 4-(1-benzyl-2-ethyl-3-oxamoyl-indol-5-yl)oxybutyric acid tert-butyl ester Formula: C27H32N2O5 MolecularWeight: 464.55338

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OCCCC(=O)OC(C)(C)C)C(=O)C(=O)N

Isomeric SMILES

CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OCCCC(=O)OC(C)(C)C)C(=O)C(=O)N

InChI

InChI=1S/C27H32N2O5/c1-5-21-24(25(31)26(28)32)20-16-19(33-15-9-12-23(30)34-27(2,3)4)13-14-22(20)29(21)17-18-10-7-6-8-11-18/h6-8,10-11,13-14,16H,5,9,12,15,17H2,1-4H3,(H2,28,32)