N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-3-nitro-benzamide

Systemtic Name: N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-3-nitro-benzamide Openeye Name: N-[4-methoxy-3-(3-pyridylmethoxy)phenyl]-3-nitro-benzamide CAS Name: N-[4-methoxy-3-(3-pyridinylmethoxy)phenyl]-3-nitrobenzamide IUPAC Name: N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-3-nitrobenzamide Traditional Name: N-[4-methoxy-3-(3-pyridylmethoxy)phenyl]-3-nitro-benzamide Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])OCC3=CN=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])OCC3=CN=CC=C3

InChI

InChI=1S/C20H17N3O5/c1-27-18-8-7-16(11-19(18)28-13-14-4-3-9-21-12-14)22-20(24)15-5-2-6-17(10-15)23(25)26/h2-12H,13H2,1H3,(H,22,24)