(E)-4-methyl-5-phosphono-2-(propan-2-ylamino)pent-3-enoic acid

Systemtic Name: (E)-4-methyl-5-phosphono-2-(propan-2-ylamino)pent-3-enoic acid Openeye Name: (E)-2-(isopropylamino)-4-methyl-5-phosphono-pent-3-enoic acid CAS Name: (E)-4-methyl-5-phosphono-2-(propan-2-ylamino)-3-pentenoic acid IUPAC Name: (E)-4-methyl-5-phosphono-2-(propan-2-ylamino)pent-3-enoic acid Traditional Name: (E)-2-(isopropylamino)-4-methyl-5-phosphono-pent-3-enoic acid Formula: C9H18NO5P MolecularWeight: 251.216681

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(C=C(C)CP(=O)(O)O)C(=O)O

Isomeric SMILES

CC(C)NC(/C=C(\C)/CP(=O)(O)O)C(=O)O

InChI

InChI=1S/C9H18NO5P/c1-6(2)10-8(9(11)12)4-7(3)5-16(13,14)15/h4,6,8,10H,5H2,1-3H3,(H,11,12)(H2,13,14,15)/b7-4+