(E)-2-azanyl-2-(1-ethanoylpiperidin-4-yl)-5-phosphono-pent-3-enoic acid

Systemtic Name: (E)-2-azanyl-2-(1-ethanoylpiperidin-4-yl)-5-phosphono-pent-3-enoic acid Openeye Name: (E)-2-(1-acetyl-4-piperidyl)-2-amino-5-phosphono-pent-3-enoic acid CAS Name: (E)-2-(1-acetyl-4-piperidinyl)-2-amino-5-phosphono-3-pentenoic acid IUPAC Name: (E)-2-(1-acetylpiperidin-4-yl)-2-amino-5-phosphonopent-3-enoic acid Traditional Name: (E)-2-(1-acetyl-4-piperidyl)-2-amino-5-phosphono-pent-3-enoic acid Formula: C12H21N2O6P MolecularWeight: 320.278701

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)C(C=CCP(=O)(O)O)(C(=O)O)N

Isomeric SMILES

CC(=O)N1CCC(CC1)C(/C=C/CP(=O)(O)O)(C(=O)O)N

InChI

InChI=1S/C12H21N2O6P/c1-9(15)14-6-3-10(4-7-14)12(13,11(16)17)5-2-8-21(18,19)20/h2,5,10H,3-4,6-8,13H2,1H3,(H,16,17)(H2,18,19,20)/b5-2+