1-[6-azanyl-2-[[4-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-butan-2-yl]amino]hexanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[6-azanyl-2-[[4-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-butan-2-yl]amino]hexanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[6-amino-2-[[1-carboxy-3-(1H-indol-3-yl)propyl]amino]hexanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[6-amino-2-[[1-hydroxy-4-(1H-indol-3-yl)-1-oxobutan-2-yl]amino]-1-oxohexyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[6-amino-2-[[1-hydroxy-4-(1H-indol-3-yl)-1-oxobutan-2-yl]amino]hexanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[6-amino-2-[[1-carboxy-3-(1H-indol-3-yl)propyl]amino]hexanoyl]proline Formula: C23H32N4O5 MolecularWeight: 444.52398

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CCCCN)NC(CCC2=CNC3=CC=CC=C32)C(=O)O)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C(CCCCN)NC(CCC2=CNC3=CC=CC=C32)C(=O)O)C(=O)O

InChI

InChI=1S/C23H32N4O5/c24-12-4-3-8-18(21(28)27-13-5-9-20(27)23(31)32)26-19(22(29)30)11-10-15-14-25-17-7-2-1-6-16(15)17/h1-2,6-7,14,18-20,25-26H,3-5,8-13,24H2,(H,29,30)(H,31,32)