1-[(1-nitro-2-phenyl-azetidin-3-yl)-(phenylmethyl)amino]-3-(4-phenylmethoxyphenoxy)propan-2-ol

Systemtic Name: 1-[(1-nitro-2-phenyl-azetidin-3-yl)-(phenylmethyl)amino]-3-(4-phenylmethoxyphenoxy)propan-2-ol Openeye Name: 1-[benzyl-(1-nitro-2-phenyl-azetidin-3-yl)amino]-3-(4-benzyloxyphenoxy)propan-2-ol CAS Name: 1-[(1-nitro-2-phenyl-3-azetidinyl)-(phenylmethyl)amino]-3-(4-phenylmethoxyphenoxy)-2-propanol IUPAC Name: 1-[benzyl-(1-nitro-2-phenylazetidin-3-yl)amino]-3-(4-phenylmethoxyphenoxy)propan-2-ol Traditional Name: 1-(4-benzoxyphenoxy)-3-[benzyl-(1-nitro-2-phenyl-azetidin-3-yl)amino]propan-2-ol Formula: C32H33N3O5 MolecularWeight: 539.62152

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(N1[N+](=O)[O-])C2=CC=CC=C2)N(CC3=CC=CC=C3)CC(COC4=CC=C(C=C4)OCC5=CC=CC=C5)O

Isomeric SMILES

C1C(C(N1[N+](=O)[O-])C2=CC=CC=C2)N(CC3=CC=CC=C3)CC(COC4=CC=C(C=C4)OCC5=CC=CC=C5)O

InChI

InChI=1S/C32H33N3O5/c36-28(24-40-30-18-16-29(17-19-30)39-23-26-12-6-2-7-13-26)21-33(20-25-10-4-1-5-11-25)31-22-34(35(37)38)32(31)27-14-8-3-9-15-27/h1-19,28,31-32,36H,20-24H2