(E)-1-phenyl-6-phosphonato-hex-4-en-3-amine hydrochloride

Systemtic Name: (E)-1-phenyl-6-phosphonato-hex-4-en-3-amine hydrochloride Openeye Name: (E)-1-phenyl-6-phosphonato-hex-4-en-3-amine hydrochloride CAS Name: (E)-1-phenyl-6-phosphonato-4-hexen-3-amine hydrochloride IUPAC Name: (E)-1-phenyl-6-phosphonatohex-4-en-3-amine hydrochloride Traditional Name: [(E)-1-phenethyl-4-phosphonato-but-2-enyl]amine hydrochloride Formula: C12H17ClNO3P-2 MolecularWeight: 289.695041

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C=CCP(=O)([O-])[O-])N.Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC(/C=C/CP(=O)([O-])[O-])N.Cl

InChI

InChI=1S/C12H18NO3P.ClH/c13-12(7-4-10-17(14,15)16)9-8-11-5-2-1-3-6-11;/h1-7,12H,8-10,13H2,(H2,14,15,16);1H/p-2/b7-4+;