methyl 2-[(3-bromanyl-4-hexoxy-phenyl)carbonylamino]benzoate

Systemtic Name: methyl 2-[(3-bromanyl-4-hexoxy-phenyl)carbonylamino]benzoate Openeye Name: methyl 2-[(3-bromo-4-hexoxy-benzoyl)amino]benzoate CAS Name: 2-[[(3-bromo-4-hexoxyphenyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(3-bromo-4-hexoxybenzoyl)amino]benzoate Traditional Name: 2-[(3-bromo-4-hexoxy-benzoyl)amino]benzoic acid methyl ester Formula: C21H24BrNO4 MolecularWeight: 434.32356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)OC)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)OC)Br

InChI

InChI=1S/C21H24BrNO4/c1-3-4-5-8-13-27-19-12-11-15(14-17(19)22)20(24)23-18-10-7-6-9-16(18)21(25)26-2/h6-7,9-12,14H,3-5,8,13H2,1-2H3,(H,23,24)