2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxy-propanamide

Systemtic Name: 2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxy-propanamide Openeye Name: 2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxy-propanamide CAS Name: 2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxypropanamide IUPAC Name: 2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxypropanamide Traditional Name: 2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)-2-phenoxy-propionamide Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-])OC3=CC=CC=C3

Isomeric SMILES

CC(C)(C(=O)NC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-])OC3=CC=CC=C3

InChI

InChI=1S/C17H15N3O4S/c1-17(2,24-12-6-4-3-5-7-12)15(21)19-16-18-13-9-8-11(20(22)23)10-14(13)25-16/h3-10H,1-2H3,(H,18,19,21)