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

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-4-nitro-N-(thiophen-2-ylmethyl)benzamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-4-nitro-N-(2-thienylmethyl)benzamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-4-nitro-N-(thiophen-2-ylmethyl)benzamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-4-nitro-N-(thiophen-2-ylmethyl)benzamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-4-nitro-N-(2-thenyl)benzamide Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O5S/c1-14-11-15(4-6-18(14)23(25)26)21(24)22(13-17-3-2-10-29-17)16-5-7-19-20(12-16)28-9-8-27-19/h2-7,10-12H,8-9,13H2,1H3