N-[(2-ethylphenyl)-phosphonato-methyl]butan-1-amine

Systemtic Name: N-[(2-ethylphenyl)-phosphonato-methyl]butan-1-amine Openeye Name: N-[(2-ethylphenyl)-phosphonato-methyl]butan-1-amine CAS Name: N-[(2-ethylphenyl)-phosphonatomethyl]-1-butanamine IUPAC Name: N-[(2-ethylphenyl)-phosphonatomethyl]butan-1-amine Traditional Name: butyl-[(2-ethylphenyl)-phosphonato-methyl]amine Formula: C13H20NO3P-2 MolecularWeight: 269.276561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(C1=CC=CC=C1CC)P(=O)([O-])[O-]

Isomeric SMILES

CCCCNC(C1=CC=CC=C1CC)P(=O)([O-])[O-]

InChI

InChI=1S/C13H22NO3P/c1-3-5-10-14-13(18(15,16)17)12-9-7-6-8-11(12)4-2/h6-9,13-14H,3-5,10H2,1-2H3,(H2,15,16,17)/p-2