1-[2-[[3-(hydroxymethyl)phenyl]carbamoylamino]ethanoyl]-5-phenyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[3-(hydroxymethyl)phenyl]carbamoylamino]ethanoyl]-5-phenyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[3-(hydroxymethyl)phenyl]carbamoylamino]acetyl]-5-phenyl-pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[[3-(hydroxymethyl)anilino]-oxomethyl]amino]-1-oxoethyl]-5-phenyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[3-(hydroxymethyl)phenyl]carbamoylamino]acetyl]-5-phenylpyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(3-methylolphenyl)carbamoylamino]acetyl]-5-phenyl-proline Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1C2=CC=CC=C2)C(=O)CNC(=O)NC3=CC=CC(=C3)CO)C(=O)O

Isomeric SMILES

C1CC(N(C1C2=CC=CC=C2)C(=O)CNC(=O)NC3=CC=CC(=C3)CO)C(=O)O

InChI

InChI=1S/C21H23N3O5/c25-13-14-5-4-8-16(11-14)23-21(29)22-12-19(26)24-17(9-10-18(24)20(27)28)15-6-2-1-3-7-15/h1-8,11,17-18,25H,9-10,12-13H2,(H,27,28)(H2,22,23,29)