[4-oxidanylidene-3-(4-phenylphenoxy)chromen-7-yl] 3,6-bis(chloranyl)-2-methoxy-benzoate

Systemtic Name: [4-oxidanylidene-3-(4-phenylphenoxy)chromen-7-yl] 3,6-bis(chloranyl)-2-methoxy-benzoate Openeye Name: [4-oxo-3-(4-phenylphenoxy)chromen-7-yl] 3,6-dichloro-2-methoxy-benzoate CAS Name: 3,6-dichloro-2-methoxybenzoic acid [4-oxo-3-(4-phenylphenoxy)-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-(4-phenylphenoxy)chromen-7-yl] 3,6-dichloro-2-methoxybenzoate Traditional Name: 3,6-dichloro-2-methoxy-benzoic acid [4-keto-3-(4-phenylphenoxy)chromen-7-yl] ester Formula: C29H18Cl2O6 MolecularWeight: 533.35562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC=C(C=C4)C5=CC=CC=C5)Cl)Cl

Isomeric SMILES

COC1=C(C=CC(=C1C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC=C(C=C4)C5=CC=CC=C5)Cl)Cl

InChI

InChI=1S/C29H18Cl2O6/c1-34-28-23(31)14-13-22(30)26(28)29(33)37-20-11-12-21-24(15-20)35-16-25(27(21)32)36-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-16H,1H3