3-azanyl-1-(2-diethylaminoethylamino)-4-nitro-xanthen-9-one

Systemtic Name: 3-azanyl-1-(2-diethylaminoethylamino)-4-nitro-xanthen-9-one Openeye Name: 3-amino-1-(2-diethylaminoethylamino)-4-nitro-xanthen-9-one CAS Name: 3-amino-1-(2-diethylaminoethylamino)-4-nitro-9-xanthenone IUPAC Name: 3-amino-1-(2-diethylaminoethylamino)-4-nitroxanthen-9-one Traditional Name: 3-amino-1-(2-diethylaminoethylamino)-4-nitro-xanthone Formula: C19H22N4O4 MolecularWeight: 370.40238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=CC(=C(C2=C1C(=O)C3=CC=CC=C3O2)[N+](=O)[O-])N

Isomeric SMILES

CCN(CC)CCNC1=CC(=C(C2=C1C(=O)C3=CC=CC=C3O2)[N+](=O)[O-])N

InChI

InChI=1S/C19H22N4O4/c1-3-22(4-2)10-9-21-14-11-13(20)17(23(25)26)19-16(14)18(24)12-7-5-6-8-15(12)27-19/h5-8,11,21H,3-4,9-10,20H2,1-2H3