2-(2-azanylpropanoyl)-3-bis(phenylmethyl)phosphoryl-1-propyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 2-(2-azanylpropanoyl)-3-bis(phenylmethyl)phosphoryl-1-propyl-pyrrolidine-2-carboxylic acid Openeye Name: 2-(2-aminopropanoyl)-3-dibenzylphosphoryl-1-propyl-pyrrolidine-2-carboxylic acid CAS Name: 2-(2-amino-1-oxopropyl)-3-bis(phenylmethyl)phosphoryl-1-propyl-2-pyrrolidinecarboxylic acid IUPAC Name: 2-(2-aminopropanoyl)-3-dibenzylphosphoryl-1-propylpyrrolidine-2-carboxylic acid Traditional Name: 2-alanyl-3-dibenzylphosphoryl-1-propyl-proline Formula: C25H33N2O4P MolecularWeight: 456.514281

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(C1(C(=O)C(C)N)C(=O)O)P(=O)(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCCN1CCC(C1(C(=O)C(C)N)C(=O)O)P(=O)(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C25H33N2O4P/c1-3-15-27-16-14-22(25(27,24(29)30)23(28)19(2)26)32(31,17-20-10-6-4-7-11-20)18-21-12-8-5-9-13-21/h4-13,19,22H,3,14-18,26H2,1-2H3,(H,29,30)