N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(6-nitroindazol-1-yl)ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(6-nitroindazol-1-yl)ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(6-nitroindazol-1-yl)acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(6-nitro-1-indazolyl)acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(6-nitroindazol-1-yl)acetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(6-nitroindazol-1-yl)acetamide Formula: C18H16N4O5 MolecularWeight: 368.34344

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CN3C4=C(C=CC(=C4)[N+](=O)[O-])C=N3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CN3C4=C(C=CC(=C4)[N+](=O)[O-])C=N3)OC1

InChI

InChI=1S/C18H16N4O5/c23-18(20-13-3-5-16-17(8-13)27-7-1-6-26-16)11-21-15-9-14(22(24)25)4-2-12(15)10-19-21/h2-5,8-10H,1,6-7,11H2,(H,20,23)