3-[2-(butanoylamino)phenyl]pentan-3-ylphosphonic acid

Systemtic Name: 3-[2-(butanoylamino)phenyl]pentan-3-ylphosphonic acid Openeye Name: [1-[2-(butanoylamino)phenyl]-1-ethyl-propyl]phosphonic acid CAS Name: 3-[2-(1-oxobutylamino)phenyl]pentan-3-ylphosphonic acid IUPAC Name: 3-[2-(butanoylamino)phenyl]pentan-3-ylphosphonic acid Traditional Name: [1-(2-butyramidophenyl)-1-ethyl-propyl]phosphonic acid Formula: C15H24NO4P MolecularWeight: 313.329121

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=CC=C1C(CC)(CC)P(=O)(O)O

Isomeric SMILES

CCCC(=O)NC1=CC=CC=C1C(CC)(CC)P(=O)(O)O

InChI

InChI=1S/C15H24NO4P/c1-4-9-14(17)16-13-11-8-7-10-12(13)15(5-2,6-3)21(18,19)20/h7-8,10-11H,4-6,9H2,1-3H3,(H,16,17)(H2,18,19,20)