N-[1-(2-diethylaminoethylamino)-4-nitro-9-oxidanylidene-xanthen-3-yl]ethanamide

Systemtic Name: N-[1-(2-diethylaminoethylamino)-4-nitro-9-oxidanylidene-xanthen-3-yl]ethanamide Openeye Name: N-[1-(2-diethylaminoethylamino)-4-nitro-9-oxo-xanthen-3-yl]acetamide CAS Name: N-[1-(2-diethylaminoethylamino)-4-nitro-9-oxo-3-xanthenyl]acetamide IUPAC Name: N-[1-(2-diethylaminoethylamino)-4-nitro-9-oxoxanthen-3-yl]acetamide Traditional Name: N-[1-(2-diethylaminoethylamino)-9-keto-4-nitro-xanthen-3-yl]acetamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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-])NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O5/c1-4-24(5-2)11-10-22-15-12-16(23-13(3)26)19(25(28)29)21-18(15)20(27)14-8-6-7-9-17(14)30-21/h6-9,12,22H,4-5,10-11H2,1-3H3,(H,23,26)