[4-[[2-bromanyl-5-(3-cyclohexylpropanoylamino)phenyl]carbamoyl]phenyl] ethanoate

Systemtic Name: [4-[[2-bromanyl-5-(3-cyclohexylpropanoylamino)phenyl]carbamoyl]phenyl] ethanoate Openeye Name: [4-[[2-bromo-5-(3-cyclohexylpropanoylamino)phenyl]carbamoyl]phenyl] acetate CAS Name: acetic acid [4-[[2-bromo-5-[(3-cyclohexyl-1-oxopropyl)amino]anilino]-oxomethyl]phenyl] ester IUPAC Name: [4-[[2-bromo-5-(3-cyclohexylpropanoylamino)phenyl]carbamoyl]phenyl] acetate Traditional Name: acetic acid [4-[[2-bromo-5-(3-cyclohexylpropanoylamino)phenyl]carbamoyl]phenyl] ester Formula: C24H27BrN2O4 MolecularWeight: 487.38618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)NC(=O)CCC3CCCCC3)Br

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)NC(=O)CCC3CCCCC3)Br

InChI

InChI=1S/C24H27BrN2O4/c1-16(28)31-20-11-8-18(9-12-20)24(30)27-22-15-19(10-13-21(22)25)26-23(29)14-7-17-5-3-2-4-6-17/h8-13,15,17H,2-7,14H2,1H3,(H,26,29)(H,27,30)