5-nitro-2-[1-(4-phenoxyphenoxy)butan-2-yloxy]pyridine

Systemtic Name: 5-nitro-2-[1-(4-phenoxyphenoxy)butan-2-yloxy]pyridine Openeye Name: 5-nitro-2-[1-[(4-phenoxyphenoxy)methyl]propoxy]pyridine CAS Name: 5-nitro-2-[1-(4-phenoxyphenoxy)butan-2-yloxy]pyridine IUPAC Name: 5-nitro-2-[1-(4-phenoxyphenoxy)butan-2-yloxy]pyridine Traditional Name: 5-nitro-2-[1-[(4-phenoxyphenoxy)methyl]propoxy]pyridine Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC1=CC=C(C=C1)OC2=CC=CC=C2)OC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(COC1=CC=C(C=C1)OC2=CC=CC=C2)OC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O5/c1-2-17(28-21-13-8-16(14-22-21)23(24)25)15-26-18-9-11-20(12-10-18)27-19-6-4-3-5-7-19/h3-14,17H,2,15H2,1H3