N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-3,5-dinitro-benzamide

Systemtic Name: N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-3,5-dinitro-benzamide Openeye Name: N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-3,5-dinitro-benzamide CAS Name: N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-3,5-dinitrobenzamide IUPAC Name: N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-3,5-dinitrobenzamide Traditional Name: N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)-3,5-dinitro-benzamide Formula: C17H14N4O6S MolecularWeight: 402.38126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])N2C

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])N2C

InChI

InChI=1S/C17H14N4O6S/c1-3-27-13-5-4-6-14-15(13)19(2)17(28-14)18-16(22)10-7-11(20(23)24)9-12(8-10)21(25)26/h4-9H,3H2,1-2H3