1-[2-[[1-ethoxy-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[1-ethoxy-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[2-ethoxy-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[1-ethoxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[1-ethoxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[2-ethoxy-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]amino]propanoyl]proline Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CNC2=CC=CC=C21)NC(C)C(=O)N3CCCC3C(=O)O

Isomeric SMILES

CCOC(=O)C(CC1=CNC2=CC=CC=C21)NC(C)C(=O)N3CCCC3C(=O)O

InChI

InChI=1S/C21H27N3O5/c1-3-29-21(28)17(11-14-12-22-16-8-5-4-7-15(14)16)23-13(2)19(25)24-10-6-9-18(24)20(26)27/h4-5,7-8,12-13,17-18,22-23H,3,6,9-11H2,1-2H3,(H,26,27)