ethyl 4-[(3-bromanyl-4-butoxy-phenyl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(3-bromanyl-4-butoxy-phenyl)carbonylamino]benzoate Openeye Name: ethyl 4-[(3-bromo-4-butoxy-benzoyl)amino]benzoate CAS Name: 4-[[(3-bromo-4-butoxyphenyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-bromo-4-butoxybenzoyl)amino]benzoate Traditional Name: 4-[(3-bromo-4-butoxy-benzoyl)amino]benzoic acid ethyl ester Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)OCC)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)OCC)Br

InChI

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