3-ethoxy-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-4-(pyridin-3-ylmethoxy)benzamide

Systemtic Name: 3-ethoxy-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-4-(pyridin-3-ylmethoxy)benzamide Openeye Name: 3-ethoxy-N-[(2-hydroxy-5-nitro-phenyl)methyl]-4-(3-pyridylmethoxy)benzamide CAS Name: 3-ethoxy-N-[(2-hydroxy-5-nitrophenyl)methyl]-4-(3-pyridinylmethoxy)benzamide IUPAC Name: 3-ethoxy-N-[(2-hydroxy-5-nitrophenyl)methyl]-4-(pyridin-3-ylmethoxy)benzamide Traditional Name: 3-ethoxy-N-(2-hydroxy-5-nitro-benzyl)-4-(3-pyridylmethoxy)benzamide Formula: C22H21N3O6 MolecularWeight: 423.41864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O)OCC3=CN=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])O)OCC3=CN=CC=C3

InChI

InChI=1S/C22H21N3O6/c1-2-30-21-11-16(5-8-20(21)31-14-15-4-3-9-23-12-15)22(27)24-13-17-10-18(25(28)29)6-7-19(17)26/h3-12,26H,2,13-14H2,1H3,(H,24,27)