3-[4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butyl]-6-nitro-1,3-benzoxazol-2-one

Systemtic Name: 3-[4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butyl]-6-nitro-1,3-benzoxazol-2-one Openeye Name: 3-[4-(4-acetylpiperazin-1-yl)-4-oxo-butyl]-6-nitro-1,3-benzoxazol-2-one CAS Name: 3-[4-(4-acetyl-1-piperazinyl)-4-oxobutyl]-6-nitro-1,3-benzoxazol-2-one IUPAC Name: 3-[4-(4-acetylpiperazin-1-yl)-4-oxobutyl]-6-nitro-1,3-benzoxazol-2-one Traditional Name: 3-[4-(4-acetylpiperazino)-4-keto-butyl]-6-nitro-1,3-benzoxazol-2-one Formula: C17H20N4O6 MolecularWeight: 376.3639

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C17H20N4O6/c1-12(22)18-7-9-19(10-8-18)16(23)3-2-6-20-14-5-4-13(21(25)26)11-15(14)27-17(20)24/h4-5,11H,2-3,6-10H2,1H3