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

Systemtic Name: 6-nitro-3-[4-oxidanylidene-4-(4-piperidin-1-ylcarbonylpiperazin-1-yl)butyl]-1,3-benzoxazol-2-one Openeye Name: 6-nitro-3-[4-oxo-4-[4-(piperidine-1-carbonyl)piperazin-1-yl]butyl]-1,3-benzoxazol-2-one CAS Name: 6-nitro-3-[4-oxo-4-[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]butyl]-1,3-benzoxazol-2-one IUPAC Name: 6-nitro-3-[4-oxo-4-[4-(piperidine-1-carbonyl)piperazin-1-yl]butyl]-1,3-benzoxazol-2-one Traditional Name: 3-[4-keto-4-[4-(piperidine-1-carbonyl)piperazino]butyl]-6-nitro-1,3-benzoxazol-2-one Formula: C21H27N5O6 MolecularWeight: 445.46898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)N2CCN(CC2)C(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

C1CCN(CC1)C(=O)N2CCN(CC2)C(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C21H27N5O6/c27-19(22-11-13-24(14-12-22)20(28)23-8-2-1-3-9-23)5-4-10-25-17-7-6-16(26(30)31)15-18(17)32-21(25)29/h6-7,15H,1-5,8-14H2