2-[2-[5-[2-(2-phosphonoethoxymethyl)prop-2-enoylamino]pentylcarbamoyl]prop-2-enoxy]ethylphosphonic acid

Systemtic Name: 2-[2-[5-[2-(2-phosphonoethoxymethyl)prop-2-enoylamino]pentylcarbamoyl]prop-2-enoxy]ethylphosphonic acid Openeye Name: 2-[2-[5-[2-(2-phosphonoethoxymethyl)prop-2-enoylamino]pentylcarbamoyl]allyloxy]ethylphosphonic acid CAS Name: 2-[2-[oxo-[5-[[1-oxo-2-(2-phosphonoethoxymethyl)prop-2-enyl]amino]pentylamino]methyl]prop-2-enoxy]ethylphosphonic acid IUPAC Name: 2-[2-[5-[2-(2-phosphonoethoxymethyl)prop-2-enoylamino]pentylcarbamoyl]prop-2-enoxy]ethylphosphonic acid Traditional Name: 2-[2-[5-[[2-(2-phosphonoethoxymethyl)acryloyl]amino]pentylcarbamoyl]allyloxy]ethylphosphonic acid Formula: C17H32N2O10P2 MolecularWeight: 486.390902

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Descriptors Computed from Structure

Canonical SMILES:

C=C(COCCP(=O)(O)O)C(=O)NCCCCCNC(=O)C(=C)COCCP(=O)(O)O

Isomeric SMILES

C=C(COCCP(=O)(O)O)C(=O)NCCCCCNC(=O)C(=C)COCCP(=O)(O)O

InChI

InChI=1S/C17H32N2O10P2/c1-14(12-28-8-10-30(22,23)24)16(20)18-6-4-3-5-7-19-17(21)15(2)13-29-9-11-31(25,26)27/h1-13H2,(H,18,20)(H,19,21)(H2,22,23,24)(H2,25,26,27)