[3-(3-phenylpropoxycarbonyl)phenyl] 3-bromanyl-4-(3-methylbutoxy)benzoate

Systemtic Name: [3-(3-phenylpropoxycarbonyl)phenyl] 3-bromanyl-4-(3-methylbutoxy)benzoate Openeye Name: [3-(3-phenylpropoxycarbonyl)phenyl] 3-bromo-4-isopentyloxy-benzoate CAS Name: 3-bromo-4-(3-methylbutoxy)benzoic acid [3-[oxo(3-phenylpropoxy)methyl]phenyl] ester IUPAC Name: [3-(3-phenylpropoxycarbonyl)phenyl] 3-bromo-4-(3-methylbutoxy)benzoate Traditional Name: 3-bromo-4-isoamoxy-benzoic acid [3-(3-phenylpropoxycarbonyl)phenyl] ester Formula: C28H29BrO5 MolecularWeight: 525.43086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCCC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCCC3=CC=CC=C3)Br

InChI

InChI=1S/C28H29BrO5/c1-20(2)15-17-32-26-14-13-23(19-25(26)29)28(31)34-24-12-6-11-22(18-24)27(30)33-16-7-10-21-8-4-3-5-9-21/h3-6,8-9,11-14,18-20H,7,10,15-17H2,1-2H3