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

Systemtic Name: 4-methoxy-3-nitro-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-methoxy-3-nitro-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-methoxy-3-nitro-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-methoxy-3-nitro-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-methoxy-3-nitro-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide Formula: C21H15N3O5S MolecularWeight: 421.4259

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)OC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)OC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O5S/c1-28-18-10-7-13(11-17(18)24(26)27)20(25)23-21-22-16-9-8-15(12-19(16)30-21)29-14-5-3-2-4-6-14/h2-12H,1H3,(H,22,23,25)