1-(5-nitro-3-phenyl-1-benzoxepin-2-yl)pyrrolidine

Systemtic Name: 1-(5-nitro-3-phenyl-1-benzoxepin-2-yl)pyrrolidine Openeye Name: 1-(5-nitro-3-phenyl-1-benzoxepin-2-yl)pyrrolidine CAS Name: 1-(5-nitro-3-phenyl-1-benzoxepin-2-yl)pyrrolidine IUPAC Name: 1-(5-nitro-3-phenyl-1-benzoxepin-2-yl)pyrrolidine Traditional Name: 1-(5-nitro-3-phenyl-1-benzoxepin-2-yl)pyrrolidine Formula: C20H18N2O3 MolecularWeight: 334.36852

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C3=CC=CC=C3O2)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C3=CC=CC=C3O2)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C20H18N2O3/c23-22(24)18-14-17(15-8-2-1-3-9-15)20(21-12-6-7-13-21)25-19-11-5-4-10-16(18)19/h1-5,8-11,14H,6-7,12-13H2