4-(3-bromanyl-4,5-dimethoxy-phenyl)-6,7-dimethoxy-3-methoxycarbonyl-naphthalene-2-carboxylic acid

Systemtic Name: 4-(3-bromanyl-4,5-dimethoxy-phenyl)-6,7-dimethoxy-3-methoxycarbonyl-naphthalene-2-carboxylic acid Openeye Name: 4-(3-bromo-4,5-dimethoxy-phenyl)-6,7-dimethoxy-3-methoxycarbonyl-naphthalene-2-carboxylic acid CAS Name: 4-(3-bromo-4,5-dimethoxyphenyl)-6,7-dimethoxy-3-methoxycarbonyl-2-naphthalenecarboxylic acid IUPAC Name: 4-(3-bromo-4,5-dimethoxyphenyl)-6,7-dimethoxy-3-methoxycarbonylnaphthalene-2-carboxylic acid Traditional Name: 4-(3-bromo-4,5-dimethoxy-phenyl)-3-carbomethoxy-6,7-dimethoxy-2-naphthoic acid Formula: C23H21BrO8 MolecularWeight: 505.31204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC(=C(C(=C2C=C1OC)C3=CC(=C(C(=C3)Br)OC)OC)C(=O)OC)C(=O)O

Isomeric SMILES

COC1=CC2=CC(=C(C(=C2C=C1OC)C3=CC(=C(C(=C3)Br)OC)OC)C(=O)OC)C(=O)O

InChI

InChI=1S/C23H21BrO8/c1-28-16-8-11-6-14(22(25)26)20(23(27)32-5)19(13(11)10-17(16)29-2)12-7-15(24)21(31-4)18(9-12)30-3/h6-10H,1-5H3,(H,25,26)