1-[6-azanyl-2-[[6-azanyl-2-(pyrrolidin-2-ylcarbonylamino)hexanoyl]amino]hexanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[6-azanyl-2-[[6-azanyl-2-(pyrrolidin-2-ylcarbonylamino)hexanoyl]amino]hexanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[6-amino-2-[[6-amino-2-(pyrrolidine-2-carbonylamino)hexanoyl]amino]hexanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[6-amino-2-[[6-amino-1-oxo-2-[[oxo(2-pyrrolidinyl)methyl]amino]hexyl]amino]-1-oxohexyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[6-amino-2-[[6-amino-2-(pyrrolidine-2-carbonylamino)hexanoyl]amino]hexanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[6-amino-2-[[6-amino-2-(prolylamino)hexanoyl]amino]hexanoyl]proline Formula: C22H40N6O5 MolecularWeight: 468.5902

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

C1CC(NC1)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C22H40N6O5/c23-11-3-1-7-16(26-19(29)15-9-5-13-25-15)20(30)27-17(8-2-4-12-24)21(31)28-14-6-10-18(28)22(32)33/h15-18,25H,1-14,23-24H2,(H,26,29)(H,27,30)(H,32,33)