3-[[4-azanyl-4-oxidanylidene-2-(pyrrolidin-2-ylcarbonylamino)butanoyl]amino]-2-oxidanyl-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 3-[[4-azanyl-4-oxidanylidene-2-(pyrrolidin-2-ylcarbonylamino)butanoyl]amino]-2-oxidanyl-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylic acid Openeye Name: 3-[[4-amino-4-oxo-2-(pyrrolidine-2-carbonylamino)butanoyl]amino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylic acid CAS Name: 3-[[4-amino-1,4-dioxo-2-[[oxo(2-pyrrolidinyl)methyl]amino]butyl]amino]-2-hydroxy-1-(1-oxo-4-phenylbutyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 3-[[4-amino-4-oxo-2-(pyrrolidine-2-carbonylamino)butanoyl]amino]-2-hydroxy-1-(4-phenylbutanoyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-[[4-amino-4-keto-2-(prolylamino)butanoyl]amino]-2-hydroxy-1-(4-phenylbutanoyl)proline Formula: C24H33N5O7 MolecularWeight: 503.54812

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)NC(CC(=O)N)C(=O)NC2CCN(C2(C(=O)O)O)C(=O)CCCC3=CC=CC=C3

Isomeric SMILES

C1CC(NC1)C(=O)NC(CC(=O)N)C(=O)NC2CCN(C2(C(=O)O)O)C(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C24H33N5O7/c25-19(30)14-17(27-21(32)16-9-5-12-26-16)22(33)28-18-11-13-29(24(18,36)23(34)35)20(31)10-4-8-15-6-2-1-3-7-15/h1-3,6-7,16-18,26,36H,4-5,8-14H2,(H2,25,30)(H,27,32)(H,28,33)(H,34,35)