2-(diethylamino)-1-phenanthren-2-yl-ethanone; tris(oxidanyl)-oxidanylidene-$l^{5}-chlorane

Systemtic Name: 2-(diethylamino)-1-phenanthren-2-yl-ethanone; tris(oxidanyl)-oxidanylidene-$l^{5}-chlorane Openeye Name: 2-(diethylamino)-1-(2-phenanthryl)ethanone; trihydroxy(oxo)-$l^{5}-chlorane CAS Name: 2-(diethylamino)-1-(2-phenanthrenyl)ethanone; trihydroxy(oxo)-$l^{5}-chlorane IUPAC Name: 2-(diethylamino)-1-phenanthren-2-ylethanone; trihydroxy(oxo)-$l^{5}-chlorane Traditional Name: 2-(diethylamino)-1-(2-phenanthryl)ethanone; trihydroxy(keto)-$l^{5}-chlorane Formula: C20H24ClNO5 MolecularWeight: 393.86126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(=O)C1=CC2=C(C=C1)C3=CC=CC=C3C=C2.OCl(=O)(O)O

Isomeric SMILES

CCN(CC)CC(=O)C1=CC2=C(C=C1)C3=CC=CC=C3C=C2.OCl(=O)(O)O

InChI

InChI=1S/C20H21NO.ClH3O4/c1-3-21(4-2)14-20(22)17-11-12-19-16(13-17)10-9-15-7-5-6-8-18(15)19;2-1(3,4)5/h5-13H,3-4,14H2,1-2H3;(H3,2,3,4,5)