N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-4-ethoxy-3-nitro-benzamide

Systemtic Name: N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-4-ethoxy-3-nitro-benzamide Openeye Name: N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-4-ethoxy-3-nitro-benzamide CAS Name: N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-4-ethoxy-3-nitrobenzamide IUPAC Name: N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-4-ethoxy-3-nitrobenzamide Traditional Name: N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-4-ethoxy-3-nitro-benzamide Formula: C18H17N3O6S MolecularWeight: 403.40908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=NC3=C(C=C(C=C3S2)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=NC3=C(C=C(C=C3S2)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O6S/c1-4-27-13-6-5-10(7-12(13)21(23)24)17(22)20-18-19-16-14(26-3)8-11(25-2)9-15(16)28-18/h5-9H,4H2,1-3H3,(H,19,20,22)