[3-(propanoylamino)phenyl] 3-bromanyl-4-propan-2-yloxy-benzoate

Systemtic Name: [3-(propanoylamino)phenyl] 3-bromanyl-4-propan-2-yloxy-benzoate Openeye Name: [3-(propanoylamino)phenyl] 3-bromo-4-isopropoxy-benzoate CAS Name: 3-bromo-4-propan-2-yloxybenzoic acid [3-(1-oxopropylamino)phenyl] ester IUPAC Name: [3-(propanoylamino)phenyl] 3-bromo-4-propan-2-yloxybenzoate Traditional Name: 3-bromo-4-isopropoxy-benzoic acid (3-propionamidophenyl) ester Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC=C1)OC(=O)C2=CC(=C(C=C2)OC(C)C)Br

Isomeric SMILES

CCC(=O)NC1=CC(=CC=C1)OC(=O)C2=CC(=C(C=C2)OC(C)C)Br

InChI

InChI=1S/C19H20BrNO4/c1-4-18(22)21-14-6-5-7-15(11-14)25-19(23)13-8-9-17(16(20)10-13)24-12(2)3/h5-12H,4H2,1-3H3,(H,21,22)