1-[2-[[4-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-butan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[4-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-butan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[1-carboxy-3-(1H-indol-3-yl)propyl]amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[1-hydroxy-4-(1H-indol-3-yl)-1-oxobutan-2-yl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[1-hydroxy-4-(1H-indol-3-yl)-1-oxobutan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[1-carboxy-3-(1H-indol-3-yl)propyl]amino]propanoyl]proline Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)O)NC(CCC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)O)NC(CCC2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C20H25N3O5/c1-12(18(24)23-10-4-7-17(23)20(27)28)22-16(19(25)26)9-8-13-11-21-15-6-3-2-5-14(13)15/h2-3,5-6,11-12,16-17,21-22H,4,7-10H2,1H3,(H,25,26)(H,27,28)