1-[2-[(3-acetamido-2-carboxy-phenyl)carbonylamino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(3-acetamido-2-carboxy-phenyl)carbonylamino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(3-acetamido-2-carboxy-benzoyl)amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[(3-acetamido-2-carboxyphenyl)-oxomethyl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(3-acetamido-2-carboxybenzoyl)amino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(3-acetamido-2-carboxy-benzoyl)amino]propanoyl]proline Formula: C18H21N3O7 MolecularWeight: 391.37524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)O)NC(=O)C2=C(C(=CC=C2)NC(=O)C)C(=O)O

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)O)NC(=O)C2=C(C(=CC=C2)NC(=O)C)C(=O)O

InChI

InChI=1S/C18H21N3O7/c1-9(16(24)21-8-4-7-13(21)17(25)26)19-15(23)11-5-3-6-12(20-10(2)22)14(11)18(27)28/h3,5-6,9,13H,4,7-8H2,1-2H3,(H,19,23)(H,20,22)(H,25,26)(H,27,28)