N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-4-(2-methylpropoxy)benzamide

Systemtic Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-4-(2-methylpropoxy)benzamide Openeye Name: 4-isobutoxy-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-4-(2-methylpropoxy)benzamide IUPAC Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-4-(2-methylpropoxy)benzamide Traditional Name: 4-isobutoxy-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)benzamide Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=O)NC2=NC3=C(C=C(C=C3S2)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C(=O)NC2=NC3=C(C=C(C=C3S2)[N+](=O)[O-])OC

InChI

InChI=1S/C19H19N3O5S/c1-11(2)10-27-14-6-4-12(5-7-14)18(23)21-19-20-17-15(26-3)8-13(22(24)25)9-16(17)28-19/h4-9,11H,10H2,1-3H3,(H,20,21,23)