4-(3-bromanyl-4,5-dimethoxy-phenyl)-7-methoxy-3-methoxycarbonyl-naphthalene-2-carboxylic acid

Systemtic Name: 4-(3-bromanyl-4,5-dimethoxy-phenyl)-7-methoxy-3-methoxycarbonyl-naphthalene-2-carboxylic acid Openeye Name: 4-(3-bromo-4,5-dimethoxy-phenyl)-7-methoxy-3-methoxycarbonyl-naphthalene-2-carboxylic acid CAS Name: 4-(3-bromo-4,5-dimethoxyphenyl)-7-methoxy-3-methoxycarbonyl-2-naphthalenecarboxylic acid IUPAC Name: 4-(3-bromo-4,5-dimethoxyphenyl)-7-methoxy-3-methoxycarbonylnaphthalene-2-carboxylic acid Traditional Name: 4-(3-bromo-4,5-dimethoxy-phenyl)-3-carbomethoxy-7-methoxy-2-naphthoic acid Formula: C22H19BrO7 MolecularWeight: 475.28606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC(=C(C(=C2C=C1)C3=CC(=C(C(=C3)Br)OC)OC)C(=O)OC)C(=O)O

Isomeric SMILES

COC1=CC2=CC(=C(C(=C2C=C1)C3=CC(=C(C(=C3)Br)OC)OC)C(=O)OC)C(=O)O

InChI

InChI=1S/C22H19BrO7/c1-27-13-5-6-14-11(7-13)8-15(21(24)25)19(22(26)30-4)18(14)12-9-16(23)20(29-3)17(10-12)28-2/h5-10H,1-4H3,(H,24,25)