4-[[furan-2-ylmethyl-[3-(3-nitrophenoxy)-2-oxidanyl-propyl]amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[furan-2-ylmethyl-[3-(3-nitrophenoxy)-2-oxidanyl-propyl]amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[2-furylmethyl-[2-hydroxy-3-(3-nitrophenoxy)propyl]amino]methyl]-N-methyl-benzamide CAS Name: 4-[[2-furanylmethyl-[2-hydroxy-3-(3-nitrophenoxy)propyl]amino]methyl]-N-methylbenzamide IUPAC Name: 4-[[furan-2-ylmethyl-[2-hydroxy-3-(3-nitrophenoxy)propyl]amino]methyl]-N-methylbenzamide Traditional Name: 4-[[2-furfuryl-[2-hydroxy-3-(3-nitrophenoxy)propyl]amino]methyl]-N-methyl-benzamide Formula: C23H25N3O6 MolecularWeight: 439.4611

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)CC(COC3=CC=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)CC(COC3=CC=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C23H25N3O6/c1-24-23(28)18-9-7-17(8-10-18)13-25(15-22-6-3-11-31-22)14-20(27)16-32-21-5-2-4-19(12-21)26(29)30/h2-12,20,27H,13-16H2,1H3,(H,24,28)