3-[4-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-nitro-1,3-benzoxazol-2-one

Systemtic Name: 3-[4-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-nitro-1,3-benzoxazol-2-one Openeye Name: 3-[4-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-4-oxo-butyl]-6-nitro-1,3-benzoxazol-2-one CAS Name: 3-[4-[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-4-oxobutyl]-6-nitro-1,3-benzoxazol-2-one IUPAC Name: 3-[4-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-4-oxobutyl]-6-nitro-1,3-benzoxazol-2-one Traditional Name: 3-[4-[4-(coumaran-5-ylmethyl)piperazino]-4-keto-butyl]-6-nitro-1,3-benzoxazol-2-one Formula: C24H26N4O6 MolecularWeight: 466.48644

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)CCCN4C5=C(C=C(C=C5)[N+](=O)[O-])OC4=O

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)CCCN4C5=C(C=C(C=C5)[N+](=O)[O-])OC4=O

InChI

InChI=1S/C24H26N4O6/c29-23(2-1-8-27-20-5-4-19(28(31)32)15-22(20)34-24(27)30)26-11-9-25(10-12-26)16-17-3-6-21-18(14-17)7-13-33-21/h3-6,14-15H,1-2,7-13,16H2