N-[(5-bromanylthiophen-2-yl)methyl]-3,4,5-trimethoxy-N-methyl-2-nitro-benzamide

Systemtic Name: N-[(5-bromanylthiophen-2-yl)methyl]-3,4,5-trimethoxy-N-methyl-2-nitro-benzamide Openeye Name: N-[(5-bromo-2-thienyl)methyl]-3,4,5-trimethoxy-N-methyl-2-nitro-benzamide CAS Name: N-[(5-bromo-2-thiophenyl)methyl]-3,4,5-trimethoxy-N-methyl-2-nitrobenzamide IUPAC Name: N-[(5-bromothiophen-2-yl)methyl]-3,4,5-trimethoxy-N-methyl-2-nitrobenzamide Traditional Name: N-[(5-bromo-2-thienyl)methyl]-3,4,5-trimethoxy-N-methyl-2-nitro-benzamide Formula: C16H17BrN2O6S MolecularWeight: 445.28498

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(S1)Br)C(=O)C2=CC(=C(C(=C2[N+](=O)[O-])OC)OC)OC

Isomeric SMILES

CN(CC1=CC=C(S1)Br)C(=O)C2=CC(=C(C(=C2[N+](=O)[O-])OC)OC)OC

InChI

InChI=1S/C16H17BrN2O6S/c1-18(8-9-5-6-12(17)26-9)16(20)10-7-11(23-2)14(24-3)15(25-4)13(10)19(21)22/h5-7H,8H2,1-4H3