propyl 4-[4-(2-bromanyl-4-propan-2-yl-phenoxy)butanoylamino]benzoate

Systemtic Name: propyl 4-[4-(2-bromanyl-4-propan-2-yl-phenoxy)butanoylamino]benzoate Openeye Name: propyl 4-[4-(2-bromo-4-isopropyl-phenoxy)butanoylamino]benzoate CAS Name: 4-[[4-(2-bromo-4-propan-2-ylphenoxy)-1-oxobutyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[4-(2-bromo-4-propan-2-ylphenoxy)butanoylamino]benzoate Traditional Name: 4-[4-(2-bromo-4-isopropyl-phenoxy)butanoylamino]benzoic acid propyl ester Formula: C23H28BrNO4 MolecularWeight: 462.37672

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CCCOC2=C(C=C(C=C2)C(C)C)Br

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CCCOC2=C(C=C(C=C2)C(C)C)Br

InChI

InChI=1S/C23H28BrNO4/c1-4-13-29-23(27)17-7-10-19(11-8-17)25-22(26)6-5-14-28-21-12-9-18(16(2)3)15-20(21)24/h7-12,15-16H,4-6,13-14H2,1-3H3,(H,25,26)