8-bromanyl-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-ol; ethanoic acid

Systemtic Name: 8-bromanyl-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-ol; ethanoic acid Openeye Name: acetic acid; 8-bromo-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-ol CAS Name: acetic acid; 8-bromo-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-ol IUPAC Name: acetic acid; 8-bromo-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-ol Traditional Name: acetic acid; 8-bromo-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-ol Formula: C19H16BrN3O3 MolecularWeight: 414.25264

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1=CC=C(C=C1)C2=NC(C3=NC=CN3C4=C2C=C(C=C4)Br)O

Isomeric SMILES

CC(=O)O.C1=CC=C(C=C1)C2=NC(C3=NC=CN3C4=C2C=C(C=C4)Br)O

InChI

InChI=1S/C17H12BrN3O.C2H4O2/c18-12-6-7-14-13(10-12)15(11-4-2-1-3-5-11)20-17(22)16-19-8-9-21(14)16;1-2(3)4/h1-10,17,22H;1H3,(H,3,4)