[3-(3-phenylpropoxycarbonyl)phenyl] 3-iodanyl-4-methyl-benzoate

Systemtic Name: [3-(3-phenylpropoxycarbonyl)phenyl] 3-iodanyl-4-methyl-benzoate Openeye Name: [3-(3-phenylpropoxycarbonyl)phenyl] 3-iodo-4-methyl-benzoate CAS Name: 3-iodo-4-methylbenzoic acid [3-[oxo(3-phenylpropoxy)methyl]phenyl] ester IUPAC Name: [3-(3-phenylpropoxycarbonyl)phenyl] 3-iodo-4-methylbenzoate Traditional Name: 3-iodo-4-methyl-benzoic acid [3-(3-phenylpropoxycarbonyl)phenyl] ester Formula: C24H21IO4 MolecularWeight: 500.32561

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCCC3=CC=CC=C3)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCCC3=CC=CC=C3)I

InChI

InChI=1S/C24H21IO4/c1-17-12-13-20(16-22(17)25)24(27)29-21-11-5-10-19(15-21)23(26)28-14-6-9-18-7-3-2-4-8-18/h2-5,7-8,10-13,15-16H,6,9,14H2,1H3