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

Systemtic Name: 4-(3-bromanyl-4,5-dimethoxy-phenyl)-3-methoxycarbonyl-naphthalene-2-carboxylic acid Openeye Name: 4-(3-bromo-4,5-dimethoxy-phenyl)-3-methoxycarbonyl-naphthalene-2-carboxylic acid CAS Name: 4-(3-bromo-4,5-dimethoxyphenyl)-3-methoxycarbonyl-2-naphthalenecarboxylic acid IUPAC Name: 4-(3-bromo-4,5-dimethoxyphenyl)-3-methoxycarbonylnaphthalene-2-carboxylic acid Traditional Name: 4-(3-bromo-4,5-dimethoxy-phenyl)-3-carbomethoxy-2-naphthoic acid Formula: C21H17BrO6 MolecularWeight: 445.26008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2=C(C(=CC3=CC=CC=C32)C(=O)O)C(=O)OC)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2=C(C(=CC3=CC=CC=C32)C(=O)O)C(=O)OC)Br)OC

InChI

InChI=1S/C21H17BrO6/c1-26-16-10-12(9-15(22)19(16)27-2)17-13-7-5-4-6-11(13)8-14(20(23)24)18(17)21(25)28-3/h4-10H,1-3H3,(H,23,24)