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

Systemtic Name: ethanoic acid; 1-methyl-8-nitro-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-ol Openeye Name: acetic acid; 1-methyl-8-nitro-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-ol CAS Name: acetic acid; 1-methyl-8-nitro-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-ol IUPAC Name: acetic acid; 1-methyl-8-nitro-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-ol Traditional Name: acetic acid; 1-methyl-8-nitro-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-4-ol Formula: C20H18N4O5 MolecularWeight: 394.38072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2N1C3=C(C=C(C=C3)[N+](=O)[O-])C(=NC2O)C4=CC=CC=C4.CC(=O)O

Isomeric SMILES

CC1=CN=C2N1C3=C(C=C(C=C3)[N+](=O)[O-])C(=NC2O)C4=CC=CC=C4.CC(=O)O

InChI

InChI=1S/C18H14N4O3.C2H4O2/c1-11-10-19-17-18(23)20-16(12-5-3-2-4-6-12)14-9-13(22(24)25)7-8-15(14)21(11)17;1-2(3)4/h2-10,18,23H,1H3;1H3,(H,3,4)