2-(azepan-1-ylcarbonyl)-1-(2-hydroxyethylamino)anthracene-9,10-dione

Systemtic Name: 2-(azepan-1-ylcarbonyl)-1-(2-hydroxyethylamino)anthracene-9,10-dione Openeye Name: 2-(azepane-1-carbonyl)-1-(2-hydroxyethylamino)anthracene-9,10-dione CAS Name: 2-[1-azepanyl(oxo)methyl]-1-(2-hydroxyethylamino)anthracene-9,10-dione IUPAC Name: 2-(azepane-1-carbonyl)-1-(2-hydroxyethylamino)anthracene-9,10-dione Traditional Name: 2-(azepane-1-carbonyl)-1-(2-hydroxyethylamino)-9,10-anthraquinone Formula: C23H24N2O4 MolecularWeight: 392.44766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=C(C3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)NCCO

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=C(C3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)NCCO

InChI

InChI=1S/C23H24N2O4/c26-14-11-24-20-18(23(29)25-12-5-1-2-6-13-25)10-9-17-19(20)22(28)16-8-4-3-7-15(16)21(17)27/h3-4,7-10,24,26H,1-2,5-6,11-14H2