5-chloranyl-3-[[4-[3-(furan-2-ylmethylamino)-4-nitro-phenyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one

Systemtic Name: 5-chloranyl-3-[[4-[3-(furan-2-ylmethylamino)-4-nitro-phenyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Openeye Name: 5-chloro-3-[[4-[3-(2-furylmethylamino)-4-nitro-phenyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one CAS Name: 5-chloro-3-[[4-[3-(2-furanylmethylamino)-4-nitrophenyl]-1-piperazinyl]methyl]-1,3-benzoxazol-2-one IUPAC Name: 5-chloro-3-[[4-[3-(furan-2-ylmethylamino)-4-nitrophenyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Traditional Name: 5-chloro-3-[[4-[3-(2-furfurylamino)-4-nitro-phenyl]piperazino]methyl]-1,3-benzoxazol-2-one Formula: C23H22ClN5O5 MolecularWeight: 483.90428

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C3=C(C=CC(=C3)Cl)OC2=O)C4=CC(=C(C=C4)[N+](=O)[O-])NCC5=CC=CO5

Isomeric SMILES

C1CN(CCN1CN2C3=C(C=CC(=C3)Cl)OC2=O)C4=CC(=C(C=C4)[N+](=O)[O-])NCC5=CC=CO5

InChI

InChI=1S/C23H22ClN5O5/c24-16-3-6-22-21(12-16)28(23(30)34-22)15-26-7-9-27(10-8-26)17-4-5-20(29(31)32)19(13-17)25-14-18-2-1-11-33-18/h1-6,11-13,25H,7-10,14-15H2