N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]-1-(4-propan-2-ylphenyl)methanimine

Systemtic Name: N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]-1-(4-propan-2-ylphenyl)methanimine Openeye Name: 1-(4-isopropylphenyl)-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]methanimine CAS Name: N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]-1-(4-propan-2-ylphenyl)methanimine IUPAC Name: N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]-1-(4-propan-2-ylphenyl)methanimine Traditional Name: (Z)-(4-isopropylbenzylidene)-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]amine Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=NOCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=N\OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C19H20N2O5/c1-13(2)15-5-3-14(4-6-15)9-20-26-11-17-8-18(21(22)23)7-16-10-24-12-25-19(16)17/h3-9,13H,10-12H2,1-2H3/b20-9-