methyl 2-[2-[2-ethyl-3-oxamoyl-1-(phenylmethyl)indol-4-yl]oxyethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[2-[2-ethyl-3-oxamoyl-1-(phenylmethyl)indol-4-yl]oxyethanoylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[2-(1-benzyl-2-ethyl-3-oxamoyl-indol-4-yl)oxyacetyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[[2-ethyl-3-oxamoyl-1-(phenylmethyl)-4-indolyl]oxy]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-(1-benzyl-2-ethyl-3-oxamoylindol-4-yl)oxyacetyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-(1-benzyl-2-ethyl-3-oxamoyl-indol-4-yl)oxyacetyl]amino]-4-methyl-valeric acid methyl ester Formula: C28H33N3O6 MolecularWeight: 507.57812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2OCC(=O)NC(CC(C)C)C(=O)OC)C(=O)C(=O)N

Isomeric SMILES

CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2OCC(=O)NC(CC(C)C)C(=O)OC)C(=O)C(=O)N

InChI

InChI=1S/C28H33N3O6/c1-5-20-25(26(33)27(29)34)24-21(31(20)15-18-10-7-6-8-11-18)12-9-13-22(24)37-16-23(32)30-19(14-17(2)3)28(35)36-4/h6-13,17,19H,5,14-16H2,1-4H3,(H2,29,34)(H,30,32)