ethyl 4-[(5-bromanyl-2-hexoxy-phenyl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(5-bromanyl-2-hexoxy-phenyl)carbonylamino]benzoate Openeye Name: ethyl 4-[(5-bromo-2-hexoxy-benzoyl)amino]benzoate CAS Name: 4-[[(5-bromo-2-hexoxyphenyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(5-bromo-2-hexoxybenzoyl)amino]benzoate Traditional Name: 4-[(5-bromo-2-hexoxy-benzoyl)amino]benzoic acid ethyl ester Formula: C22H26BrNO4 MolecularWeight: 448.35014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C22H26BrNO4/c1-3-5-6-7-14-28-20-13-10-17(23)15-19(20)21(25)24-18-11-8-16(9-12-18)22(26)27-4-2/h8-13,15H,3-7,14H2,1-2H3,(H,24,25)