2-cyano-N-[4-(3-phosphonatopentan-3-yl)phenyl]ethanamide

Systemtic Name: 2-cyano-N-[4-(3-phosphonatopentan-3-yl)phenyl]ethanamide Openeye Name: 2-cyano-N-[4-(1-ethyl-1-phosphonato-propyl)phenyl]acetamide CAS Name: 2-cyano-N-[4-(3-phosphonatopentan-3-yl)phenyl]acetamide IUPAC Name: 2-cyano-N-[4-(3-phosphonatopentan-3-yl)phenyl]acetamide Traditional Name: 2-cyano-N-[4-(1-ethyl-1-phosphonato-propyl)phenyl]acetamide Formula: C14H17N2O4P-2 MolecularWeight: 308.269541

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC=C(C=C1)NC(=O)CC#N)P(=O)([O-])[O-]

Isomeric SMILES

CCC(CC)(C1=CC=C(C=C1)NC(=O)CC#N)P(=O)([O-])[O-]

InChI

InChI=1S/C14H19N2O4P/c1-3-14(4-2,21(18,19)20)11-5-7-12(8-6-11)16-13(17)9-10-15/h5-8H,3-4,9H2,1-2H3,(H,16,17)(H2,18,19,20)/p-2