1-[3-(4-nitroimidazol-1-yl)propylamino]anthracene-9,10-dione

Systemtic Name: 1-[3-(4-nitroimidazol-1-yl)propylamino]anthracene-9,10-dione Openeye Name: 1-[3-(4-nitroimidazol-1-yl)propylamino]anthracene-9,10-dione CAS Name: 1-[3-(4-nitro-1-imidazolyl)propylamino]anthracene-9,10-dione IUPAC Name: 1-[3-(4-nitroimidazol-1-yl)propylamino]anthracene-9,10-dione Traditional Name: 1-[3-(4-nitroimidazol-1-yl)propylamino]-9,10-anthraquinone Formula: C20H16N4O4 MolecularWeight: 376.36544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NCCCN4C=C(N=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NCCCN4C=C(N=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H16N4O4/c25-19-13-5-1-2-6-14(13)20(26)18-15(19)7-3-8-16(18)21-9-4-10-23-11-17(22-12-23)24(27)28/h1-3,5-8,11-12,21H,4,9-10H2