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

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethoxy-3-nitro-N-(thiophen-2-ylmethyl)benzamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethoxy-3-nitro-N-(2-thienylmethyl)benzamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethoxy-3-nitro-N-(thiophen-2-ylmethyl)benzamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethoxy-3-nitro-N-(thiophen-2-ylmethyl)benzamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethoxy-3-nitro-N-(2-thenyl)benzamide Formula: C22H20N2O6S MolecularWeight: 440.469

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O6S/c1-2-28-19-7-5-15(12-18(19)24(26)27)22(25)23(14-17-4-3-11-31-17)16-6-8-20-21(13-16)30-10-9-29-20/h3-8,11-13H,2,9-10,14H2,1H3