sodium 1-[1-(2-azanyl-3-phenyl-propanoyl)pyrrolidin-2-yl]carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: sodium 1-[1-(2-azanyl-3-phenyl-propanoyl)pyrrolidin-2-yl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: sodium 1-[1-(2-amino-3-phenyl-propanoyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid CAS Name: sodium 1-[[1-(2-amino-1-oxo-3-phenylpropyl)-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: sodium 1-[1-(2-amino-3-phenylpropanoyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid Traditional Name: sodium 1-(1-phenylalanylprolyl)proline Formula: C19H25N3NaO4+ MolecularWeight: 382.40927

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CCCN2C(=O)C(CC3=CC=CC=C3)N)C(=O)O.[Na+]

Isomeric SMILES

C1CC(N(C1)C(=O)C2CCCN2C(=O)C(CC3=CC=CC=C3)N)C(=O)O.[Na+]

InChI

InChI=1S/C19H25N3O4.Na/c20-14(12-13-6-2-1-3-7-13)17(23)21-10-4-8-15(21)18(24)22-11-5-9-16(22)19(25)26;/h1-3,6-7,14-16H,4-5,8-12,20H2,(H,25,26);/q;+1