N-(6-nitro-1,3-benzothiazol-2-yl)-2-(3,4,5-trimethoxyphenyl)ethanamide

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(3,4,5-trimethoxyphenyl)ethanamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(3,4,5-trimethoxyphenyl)acetamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(3,4,5-trimethoxyphenyl)acetamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(3,4,5-trimethoxyphenyl)acetamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(3,4,5-trimethoxyphenyl)acetamide Formula: C18H17N3O6S MolecularWeight: 403.40908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O6S/c1-25-13-6-10(7-14(26-2)17(13)27-3)8-16(22)20-18-19-12-5-4-11(21(23)24)9-15(12)28-18/h4-7,9H,8H2,1-3H3,(H,19,20,22)