propyl 4-[[3-bromanyl-4-(3-methylbutoxy)phenyl]carbonylamino]benzoate

Systemtic Name: propyl 4-[[3-bromanyl-4-(3-methylbutoxy)phenyl]carbonylamino]benzoate Openeye Name: propyl 4-[(3-bromo-4-isopentyloxy-benzoyl)amino]benzoate CAS Name: 4-[[[3-bromo-4-(3-methylbutoxy)phenyl]-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[3-bromo-4-(3-methylbutoxy)benzoyl]amino]benzoate Traditional Name: 4-[(3-bromo-4-isoamoxy-benzoyl)amino]benzoic acid propyl ester Formula: C22H26BrNO4 MolecularWeight: 448.35014

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)OCCC(C)C)Br

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)OCCC(C)C)Br

InChI

InChI=1S/C22H26BrNO4/c1-4-12-28-22(26)16-5-8-18(9-6-16)24-21(25)17-7-10-20(19(23)14-17)27-13-11-15(2)3/h5-10,14-15H,4,11-13H2,1-3H3,(H,24,25)