ethyl 3-[(3-bromophenyl)carbamoyl]-5-(5-diethoxyphosphorylfuran-2-yl)benzoate

Systemtic Name: ethyl 3-[(3-bromophenyl)carbamoyl]-5-(5-diethoxyphosphorylfuran-2-yl)benzoate Openeye Name: ethyl 3-[(3-bromophenyl)carbamoyl]-5-(5-diethoxyphosphoryl-2-furyl)benzoate CAS Name: 3-[(3-bromoanilino)-oxomethyl]-5-(5-diethoxyphosphoryl-2-furanyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-[(3-bromophenyl)carbamoyl]-5-(5-diethoxyphosphorylfuran-2-yl)benzoate Traditional Name: 3-[(3-bromophenyl)carbamoyl]-5-(5-diethoxyphosphoryl-2-furyl)benzoic acid ethyl ester Formula: C24H25BrNO7P MolecularWeight: 550.335561

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC(=CC=C2)Br)C3=CC=C(O3)P(=O)(OCC)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC(=CC=C2)Br)C3=CC=C(O3)P(=O)(OCC)OCC

InChI

InChI=1S/C24H25BrNO7P/c1-4-30-24(28)18-13-16(21-10-11-22(33-21)34(29,31-5-2)32-6-3)12-17(14-18)23(27)26-20-9-7-8-19(25)15-20/h7-15H,4-6H2,1-3H3,(H,26,27)