[5-[2-[(3-bromophenyl)carbamoyl]-4-ethoxycarbonyl-phenyl]furan-2-yl]phosphonic acid

Systemtic Name: [5-[2-[(3-bromophenyl)carbamoyl]-4-ethoxycarbonyl-phenyl]furan-2-yl]phosphonic acid Openeye Name: [5-[2-[(3-bromophenyl)carbamoyl]-4-ethoxycarbonyl-phenyl]-2-furyl]phosphonic acid CAS Name: [5-[2-[(3-bromoanilino)-oxomethyl]-4-ethoxycarbonylphenyl]-2-furanyl]phosphonic acid IUPAC Name: [5-[2-[(3-bromophenyl)carbamoyl]-4-ethoxycarbonylphenyl]furan-2-yl]phosphonic acid Traditional Name: [5-[2-[(3-bromophenyl)carbamoyl]-4-carbethoxy-phenyl]-2-furyl]phosphonic acid Formula: C20H17BrNO7P MolecularWeight: 494.229241

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C2=CC=C(O2)P(=O)(O)O)C(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C2=CC=C(O2)P(=O)(O)O)C(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C20H17BrNO7P/c1-2-28-20(24)12-6-7-15(17-8-9-18(29-17)30(25,26)27)16(10-12)19(23)22-14-5-3-4-13(21)11-14/h3-11H,2H2,1H3,(H,22,23)(H2,25,26,27)