1-(4-fluoranyl-3-nitro-phenyl)-7-(4-methoxy-3-propan-2-yloxy-phenyl)heptan-3-ol

Systemtic Name: 1-(4-fluoranyl-3-nitro-phenyl)-7-(4-methoxy-3-propan-2-yloxy-phenyl)heptan-3-ol Openeye Name: 1-(4-fluoro-3-nitro-phenyl)-7-(3-isopropoxy-4-methoxy-phenyl)heptan-3-ol CAS Name: 1-(4-fluoro-3-nitrophenyl)-7-(4-methoxy-3-propan-2-yloxyphenyl)-3-heptanol IUPAC Name: 1-(4-fluoro-3-nitrophenyl)-7-(4-methoxy-3-propan-2-yloxyphenyl)heptan-3-ol Traditional Name: 1-(4-fluoro-3-nitro-phenyl)-7-(3-isopropoxy-4-methoxy-phenyl)heptan-3-ol Formula: C23H30FNO5 MolecularWeight: 419.486403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=CC(=C1)CCCCC(CCC2=CC(=C(C=C2)F)[N+](=O)[O-])O)OC

Isomeric SMILES

CC(C)OC1=C(C=CC(=C1)CCCCC(CCC2=CC(=C(C=C2)F)[N+](=O)[O-])O)OC

InChI

InChI=1S/C23H30FNO5/c1-16(2)30-23-15-17(10-13-22(23)29-3)6-4-5-7-19(26)11-8-18-9-12-20(24)21(14-18)25(27)28/h9-10,12-16,19,26H,4-8,11H2,1-3H3