5-nitro-2-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)benzenecarbonitrile Openeye Name: 5-nitro-2-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)benzonitrile CAS Name: 5-nitro-2-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]ylamino)benzonitrile IUPAC Name: 5-nitro-2-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)benzonitrile Traditional Name: 5-nitro-2-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)benzonitrile Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC4=C(C=C(C=C4)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC4=C(C=C(C=C4)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H15N3O4/c19-11-12-9-14(21(22)23)4-5-15(12)20-13-3-6-16-17(10-13)25-18(24-16)7-1-2-8-18/h3-6,9-10,20H,1-2,7-8H2