4-(3-bromanylpyridin-4-yl)-6,7-dimethoxy-3-methoxycarbonyl-naphthalene-2-carboxylic acid

Systemtic Name: 4-(3-bromanylpyridin-4-yl)-6,7-dimethoxy-3-methoxycarbonyl-naphthalene-2-carboxylic acid Openeye Name: 4-(3-bromo-4-pyridyl)-6,7-dimethoxy-3-methoxycarbonyl-naphthalene-2-carboxylic acid CAS Name: 4-(3-bromo-4-pyridinyl)-6,7-dimethoxy-3-methoxycarbonyl-2-naphthalenecarboxylic acid IUPAC Name: 4-(3-bromopyridin-4-yl)-6,7-dimethoxy-3-methoxycarbonylnaphthalene-2-carboxylic acid Traditional Name: 4-(3-bromo-4-pyridyl)-3-carbomethoxy-6,7-dimethoxy-2-naphthoic acid Formula: C20H16BrNO6 MolecularWeight: 446.24814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16BrNO6/c1-26-15-7-10-6-13(19(23)24)18(20(25)28-3)17(12(10)8-16(15)27-2)11-4-5-22-9-14(11)21/h4-9H,1-3H3,(H,23,24)