5,8-bis(bromanyl)-3-[4-(diethylamino)-2-oxidanyl-phenyl]carbonyl-naphthalene-2-carboxylic acid

Systemtic Name: 5,8-bis(bromanyl)-3-[4-(diethylamino)-2-oxidanyl-phenyl]carbonyl-naphthalene-2-carboxylic acid Openeye Name: 5,8-dibromo-3-[4-(diethylamino)-2-hydroxy-benzoyl]naphthalene-2-carboxylic acid CAS Name: 5,8-dibromo-3-[[4-(diethylamino)-2-hydroxyphenyl]-oxomethyl]-2-naphthalenecarboxylic acid IUPAC Name: 5,8-dibromo-3-[4-(diethylamino)-2-hydroxybenzoyl]naphthalene-2-carboxylic acid Traditional Name: 5,8-dibromo-3-[4-(diethylamino)-2-hydroxy-benzoyl]-2-naphthoic acid Formula: C22H19Br2NO4 MolecularWeight: 521.19856

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)C(=O)C2=CC3=C(C=CC(=C3C=C2C(=O)O)Br)Br)O

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)C(=O)C2=CC3=C(C=CC(=C3C=C2C(=O)O)Br)Br)O

InChI

InChI=1S/C22H19Br2NO4/c1-3-25(4-2)12-5-6-13(20(26)9-12)21(27)16-10-14-15(11-17(16)22(28)29)19(24)8-7-18(14)23/h5-11,26H,3-4H2,1-2H3,(H,28,29)