N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methoxy-3-nitro-N-(thiophen-2-ylmethyl)benzamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methoxy-3-nitro-N-(thiophen-2-ylmethyl)benzamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methoxy-3-nitro-N-(2-thienylmethyl)benzamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methoxy-3-nitro-N-(thiophen-2-ylmethyl)benzamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methoxy-3-nitro-N-(thiophen-2-ylmethyl)benzamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methoxy-3-nitro-N-(2-thenyl)benzamide Formula: C21H18N2O6S MolecularWeight: 426.44242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O6S/c1-27-18-6-4-14(11-17(18)23(25)26)21(24)22(13-16-3-2-10-30-16)15-5-7-19-20(12-15)29-9-8-28-19/h2-7,10-12H,8-9,13H2,1H3