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

Systemtic Name: [2-(propanoylamino)phenyl] 3-bromanyl-4-butoxy-benzoate Openeye Name: [2-(propanoylamino)phenyl] 3-bromo-4-butoxy-benzoate CAS Name: 3-bromo-4-butoxybenzoic acid [2-(1-oxopropylamino)phenyl] ester IUPAC Name: [2-(propanoylamino)phenyl] 3-bromo-4-butoxybenzoate Traditional Name: 3-bromo-4-butoxy-benzoic acid (2-propionamidophenyl) ester Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2NC(=O)CC)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2NC(=O)CC)Br

InChI

InChI=1S/C20H22BrNO4/c1-3-5-12-25-17-11-10-14(13-15(17)21)20(24)26-18-9-7-6-8-16(18)22-19(23)4-2/h6-11,13H,3-5,12H2,1-2H3,(H,22,23)