1-[3-nitro-4-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)phenyl]ethanone

Systemtic Name: 1-[3-nitro-4-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)phenyl]ethanone Openeye Name: 1-[3-nitro-4-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)phenyl]ethanone CAS Name: 1-[3-nitro-4-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]ylamino)phenyl]ethanone IUPAC Name: 1-[3-nitro-4-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)phenyl]ethanone Traditional Name: 1-[3-nitro-4-(spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylamino)phenyl]ethanone Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)NC2=CC3=C(C=C2)OC4(O3)CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)NC2=CC3=C(C=C2)OC4(O3)CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O5/c1-12(22)13-4-6-15(16(10-13)21(23)24)20-14-5-7-17-18(11-14)26-19(25-17)8-2-3-9-19/h4-7,10-11,20H,2-3,8-9H2,1H3