3-[2-(3,4-dinitrophenoxy)ethoxy]-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine

Systemtic Name: 3-[2-(3,4-dinitrophenoxy)ethoxy]-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine Openeye Name: 4-[4-(3-benzyloxypropoxy)phenyl]-3-[2-(3,4-dinitrophenoxy)ethoxy]piperidine CAS Name: 3-[2-(3,4-dinitrophenoxy)ethoxy]-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine IUPAC Name: 3-[2-(3,4-dinitrophenoxy)ethoxy]-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine Traditional Name: 4-[4-(3-benzoxypropoxy)phenyl]-3-[2-(3,4-dinitrophenoxy)ethoxy]piperidine Formula: C29H33N3O8 MolecularWeight: 551.58762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C1C2=CC=C(C=C2)OCCCOCC3=CC=CC=C3)OCCOC4=CC(=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CNCC(C1C2=CC=C(C=C2)OCCCOCC3=CC=CC=C3)OCCOC4=CC(=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C29H33N3O8/c33-31(34)27-12-11-25(19-28(27)32(35)36)39-17-18-40-29-20-30-14-13-26(29)23-7-9-24(10-8-23)38-16-4-15-37-21-22-5-2-1-3-6-22/h1-3,5-12,19,26,29-30H,4,13-18,20-21H2