1-[2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]-3-(1H-indol-3-yl)propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]-3-(1H-indol-3-yl)propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(2-amino-5-hydroxy-5-oxo-pentanoyl)amino]-3-(1H-indol-3-yl)propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(2-amino-5-hydroxy-1,5-dioxopentyl)amino]-3-(1H-indol-3-yl)-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(2-amino-5-hydroxy-5-oxopentanoyl)amino]-3-(1H-indol-3-yl)propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(2-amino-5-hydroxy-5-keto-pentanoyl)amino]-3-(1H-indol-3-yl)propanoyl]proline Formula: C21H26N4O6 MolecularWeight: 430.45434

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C(CCC(=O)O)N)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C(CCC(=O)O)N)C(=O)O

InChI

InChI=1S/C21H26N4O6/c22-14(7-8-18(26)27)19(28)24-16(20(29)25-9-3-6-17(25)21(30)31)10-12-11-23-15-5-2-1-4-13(12)15/h1-2,4-5,11,14,16-17,23H,3,6-10,22H2,(H,24,28)(H,26,27)(H,30,31)