1-[2-[2-(2-azanylethoxy)ethyl]-3-carboxy-5-phenyl-pentanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[2-(2-azanylethoxy)ethyl]-3-carboxy-5-phenyl-pentanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[2-(2-aminoethoxy)ethyl]-3-carboxy-5-phenyl-pentanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[2-(2-aminoethoxy)ethyl]-3-carboxy-1-oxo-5-phenylpentyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[2-(2-aminoethoxy)ethyl]-3-carboxy-5-phenylpentanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[2-(2-aminoethoxy)ethyl]-3-carboxy-5-phenyl-pentanoyl]proline Formula: C21H30N2O6 MolecularWeight: 406.4727

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CCOCCN)C(CCC2=CC=CC=C2)C(=O)O)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C(CCOCCN)C(CCC2=CC=CC=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C21H30N2O6/c22-11-14-29-13-10-16(19(24)23-12-4-7-18(23)21(27)28)17(20(25)26)9-8-15-5-2-1-3-6-15/h1-3,5-6,16-18H,4,7-14,22H2,(H,25,26)(H,27,28)