N-[2-(5-bromanylthiophen-2-yl)ethyl]-5-ethoxy-4-methoxy-2-nitro-benzamide

Systemtic Name: N-[2-(5-bromanylthiophen-2-yl)ethyl]-5-ethoxy-4-methoxy-2-nitro-benzamide Openeye Name: N-[2-(5-bromo-2-thienyl)ethyl]-5-ethoxy-4-methoxy-2-nitro-benzamide CAS Name: N-[2-(5-bromo-2-thiophenyl)ethyl]-5-ethoxy-4-methoxy-2-nitrobenzamide IUPAC Name: N-[2-(5-bromothiophen-2-yl)ethyl]-5-ethoxy-4-methoxy-2-nitrobenzamide Traditional Name: N-[2-(5-bromo-2-thienyl)ethyl]-5-ethoxy-4-methoxy-2-nitro-benzamide Formula: C16H17BrN2O5S MolecularWeight: 429.28558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)NCCC2=CC=C(S2)Br)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)NCCC2=CC=C(S2)Br)[N+](=O)[O-])OC

InChI

InChI=1S/C16H17BrN2O5S/c1-3-24-14-8-11(12(19(21)22)9-13(14)23-2)16(20)18-7-6-10-4-5-15(17)25-10/h4-5,8-9H,3,6-7H2,1-2H3,(H,18,20)