3-[(4-bromophenyl)carbamoyl]pentan-3-ylphosphonic acid

Systemtic Name: 3-[(4-bromophenyl)carbamoyl]pentan-3-ylphosphonic acid Openeye Name: [1-[(4-bromophenyl)carbamoyl]-1-ethyl-propyl]phosphonic acid CAS Name: 3-[(4-bromoanilino)-oxomethyl]pentan-3-ylphosphonic acid IUPAC Name: 3-[(4-bromophenyl)carbamoyl]pentan-3-ylphosphonic acid Traditional Name: [1-[(4-bromophenyl)carbamoyl]-1-ethyl-propyl]phosphonic acid Formula: C12H17BrNO4P MolecularWeight: 350.145441

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)NC1=CC=C(C=C1)Br)P(=O)(O)O

Isomeric SMILES

CCC(CC)(C(=O)NC1=CC=C(C=C1)Br)P(=O)(O)O

InChI

InChI=1S/C12H17BrNO4P/c1-3-12(4-2,19(16,17)18)11(15)14-10-7-5-9(13)6-8-10/h5-8H,3-4H2,1-2H3,(H,14,15)(H2,16,17,18)