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

Systemtic Name: propyl 4-[(3-bromanyl-4-butoxy-phenyl)carbonylamino]benzoate Openeye Name: propyl 4-[(3-bromo-4-butoxy-benzoyl)amino]benzoate CAS Name: 4-[[(3-bromo-4-butoxyphenyl)-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(3-bromo-4-butoxybenzoyl)amino]benzoate Traditional Name: 4-[(3-bromo-4-butoxy-benzoyl)amino]benzoic acid propyl ester Formula: C21H24BrNO4 MolecularWeight: 434.32356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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