N-(6-butyl-1,3-benzothiazol-2-yl)-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-(4-nitrophenoxy)ethanamide Openeye Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-(4-nitrophenoxy)acetamide CAS Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-(4-nitrophenoxy)acetamide IUPAC Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-(4-nitrophenoxy)acetamide Traditional Name: N-(6-butyl-1,3-benzothiazol-2-yl)-2-(4-nitrophenoxy)acetamide Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O4S/c1-2-3-4-13-5-10-16-17(11-13)27-19(20-16)21-18(23)12-26-15-8-6-14(7-9-15)22(24)25/h5-11H,2-4,12H2,1H3,(H,20,21,23)