1-[[ethoxy(4-phenylbutyl)phosphoryl]methylcarbamoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[[ethoxy(4-phenylbutyl)phosphoryl]methylcarbamoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[[ethoxy(4-phenylbutyl)phosphoryl]methylcarbamoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[[ethoxy(4-phenylbutyl)phosphoryl]methylamino]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[[ethoxy(4-phenylbutyl)phosphoryl]methylcarbamoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[ethoxy(4-phenylbutyl)phosphoryl]methylcarbamoyl]proline Formula: C19H29N2O5P MolecularWeight: 396.417721

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCCCC1=CC=CC=C1)CNC(=O)N2CCCC2C(=O)O

Isomeric SMILES

CCOP(=O)(CCCCC1=CC=CC=C1)CNC(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C19H29N2O5P/c1-2-26-27(25,14-7-6-11-16-9-4-3-5-10-16)15-20-19(24)21-13-8-12-17(21)18(22)23/h3-5,9-10,17H,2,6-8,11-15H2,1H3,(H,20,24)(H,22,23)