[4-[(2,5-dimethylphenyl)carbamoyl]phenyl] 4-(2-bromanyl-4-propan-2-yl-phenoxy)butanoate

Systemtic Name: [4-[(2,5-dimethylphenyl)carbamoyl]phenyl] 4-(2-bromanyl-4-propan-2-yl-phenoxy)butanoate Openeye Name: [4-[(2,5-dimethylphenyl)carbamoyl]phenyl] 4-(2-bromo-4-isopropyl-phenoxy)butanoate CAS Name: 4-(2-bromo-4-propan-2-ylphenoxy)butanoic acid [4-[(2,5-dimethylanilino)-oxomethyl]phenyl] ester IUPAC Name: [4-[(2,5-dimethylphenyl)carbamoyl]phenyl] 4-(2-bromo-4-propan-2-ylphenoxy)butanoate Traditional Name: 4-(2-bromo-4-isopropyl-phenoxy)butyric acid [4-[(2,5-dimethylphenyl)carbamoyl]phenyl] ester Formula: C28H30BrNO4 MolecularWeight: 524.4461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C2=CC=C(C=C2)OC(=O)CCCOC3=C(C=C(C=C3)C(C)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C2=CC=C(C=C2)OC(=O)CCCOC3=C(C=C(C=C3)C(C)C)Br

InChI

InChI=1S/C28H30BrNO4/c1-18(2)22-11-14-26(24(29)17-22)33-15-5-6-27(31)34-23-12-9-21(10-13-23)28(32)30-25-16-19(3)7-8-20(25)4/h7-14,16-18H,5-6,15H2,1-4H3,(H,30,32)