N-(1,3-benzothiazol-2-ylmethoxy)-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine

Systemtic Name: N-(1,3-benzothiazol-2-ylmethoxy)-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine Openeye Name: N-(1,3-benzothiazol-2-ylmethoxy)-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine CAS Name: N-(1,3-benzothiazol-2-ylmethoxy)-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine IUPAC Name: N-(1,3-benzothiazol-2-ylmethoxy)-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine Traditional Name: (Z)-1,3-benzothiazol-2-ylmethoxy-[(6-nitro-1,3-benzodioxol-5-yl)methylene]amine Formula: C16H11N3O5S MolecularWeight: 357.34064

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NOCC3=NC4=CC=CC=C4S3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=N\OCC3=NC4=CC=CC=C4S3)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O5S/c20-19(21)12-6-14-13(22-9-23-14)5-10(12)7-17-24-8-16-18-11-3-1-2-4-15(11)25-16/h1-7H,8-9H2/b17-7-