1-[2-[1-benzamidopentyl(oxidanyl)phosphoryl]oxypropanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[1-benzamidopentyl(oxidanyl)phosphoryl]oxypropanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[1-benzamidopentyl(hydroxy)phosphoryl]oxypropanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[1-benzamidopentyl(hydroxy)phosphoryl]oxy-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[1-benzamidopentyl(hydroxy)phosphoryl]oxypropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[1-benzamidopentyl(hydroxy)phosphoryl]oxypropanoyl]proline Formula: C20H29N2O7P MolecularWeight: 440.427221

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(NC(=O)C1=CC=CC=C1)P(=O)(O)OC(C)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CCCCC(NC(=O)C1=CC=CC=C1)P(=O)(O)OC(C)C(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C20H29N2O7P/c1-3-4-12-17(21-18(23)15-9-6-5-7-10-15)30(27,28)29-14(2)19(24)22-13-8-11-16(22)20(25)26/h5-7,9-10,14,16-17H,3-4,8,11-13H2,1-2H3,(H,21,23)(H,25,26)(H,27,28)