3-[ethanoyl-[2-ethyl-3-oxamoyl-1-(phenylmethyl)indol-4-yl]amino]propanoic acid

Systemtic Name: 3-[ethanoyl-[2-ethyl-3-oxamoyl-1-(phenylmethyl)indol-4-yl]amino]propanoic acid Openeye Name: 3-[acetyl-(1-benzyl-2-ethyl-3-oxamoyl-indol-4-yl)amino]propanoic acid CAS Name: 3-[acetyl-[2-ethyl-3-oxamoyl-1-(phenylmethyl)-4-indolyl]amino]propanoic acid IUPAC Name: 3-[acetyl-(1-benzyl-2-ethyl-3-oxamoylindol-4-yl)amino]propanoic acid Traditional Name: 3-[acetyl-(1-benzyl-2-ethyl-3-oxamoyl-indol-4-yl)amino]propionic acid Formula: C24H25N3O5 MolecularWeight: 435.4724

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2N(CCC(=O)O)C(=O)C)C(=O)C(=O)N

Isomeric SMILES

CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2N(CCC(=O)O)C(=O)C)C(=O)C(=O)N

InChI

InChI=1S/C24H25N3O5/c1-3-17-22(23(31)24(25)32)21-18(26(15(2)28)13-12-20(29)30)10-7-11-19(21)27(17)14-16-8-5-4-6-9-16/h4-11H,3,12-14H2,1-2H3,(H2,25,32)(H,29,30)