(E)-3-chloranyl-2-phosphonooxy-prop-2-enoic acid; N,N-diethylethanamine

Systemtic Name: (E)-3-chloranyl-2-phosphonooxy-prop-2-enoic acid; N,N-diethylethanamine Openeye Name: (E)-3-chloro-2-phosphonooxy-prop-2-enoic acid; N,N-diethylethanamine CAS Name: (E)-3-chloro-2-phosphonooxy-2-propenoic acid; N,N-diethylethanamine IUPAC Name: (E)-3-chloro-2-phosphonooxyprop-2-enoic acid; N,N-diethylethanamine Traditional Name: (E)-3-chloro-2-phosphonooxy-acrylic acid; triethylamine Formula: C15H34ClN2O6P MolecularWeight: 404.867021

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.CCN(CC)CC.C(=C(C(=O)O)OP(=O)(O)O)Cl

Isomeric SMILES

CCN(CC)CC.CCN(CC)CC.C(=C(\C(=O)O)/OP(=O)(O)O)\Cl

InChI

InChI=1S/2C6H15N.C3H4ClO6P/c2*1-4-7(5-2)6-3;4-1-2(3(5)6)10-11(7,8)9/h2*4-6H2,1-3H3;1H,(H,5,6)(H2,7,8,9)/b;;2-1+