benzoic acid; 5,7-bis(bromanyl)-2-methyl-quinolin-8-ol

Systemtic Name: benzoic acid; 5,7-bis(bromanyl)-2-methyl-quinolin-8-ol Openeye Name: benzoic acid; 5,7-dibromo-2-methyl-quinolin-8-ol CAS Name: benzoic acid; 5,7-dibromo-2-methyl-8-quinolinol IUPAC Name: benzoic acid; 5,7-dibromo-2-methylquinolin-8-ol Traditional Name: benzoic acid; 5,7-dibromo-2-methyl-quinolin-8-ol Formula: C17H13Br2NO3 MolecularWeight: 439.09802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC(=C2O)Br)Br.C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC(=C2O)Br)Br.C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C10H7Br2NO.C7H6O2/c1-5-2-3-6-7(11)4-8(12)10(14)9(6)13-5;8-7(9)6-4-2-1-3-5-6/h2-4,14H,1H3;1-5H,(H,8,9)