N-(1,3-benzothiazol-2-ylmethyl)-4-nitro-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-4-nitro-benzamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-4-nitro-benzamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-4-nitrobenzamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-4-nitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-nitro-benzamide Formula: C15H11N3O3S MolecularWeight: 313.33114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O3S/c19-15(10-5-7-11(8-6-10)18(20)21)16-9-14-17-12-3-1-2-4-13(12)22-14/h1-8H,9H2,(H,16,19)