N-[butan-2-ylsulfanyl(ethoxy)phosphoryl]-N-[(3-nitrophenyl)methyl]methanamide

Systemtic Name: N-[butan-2-ylsulfanyl(ethoxy)phosphoryl]-N-[(3-nitrophenyl)methyl]methanamide Openeye Name: N-[ethoxy(sec-butylsulfanyl)phosphoryl]-N-[(3-nitrophenyl)methyl]formamide CAS Name: N-[(butan-2-ylthio)-ethoxyphosphoryl]-N-[(3-nitrophenyl)methyl]formamide IUPAC Name: N-[butan-2-ylsulfanyl(ethoxy)phosphoryl]-N-[(3-nitrophenyl)methyl]formamide Traditional Name: N-[ethoxy-(sec-butylthio)phosphoryl]-N-(3-nitrobenzyl)formamide Formula: C14H21N2O5PS MolecularWeight: 360.365701

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SP(=O)(N(CC1=CC(=CC=C1)[N+](=O)[O-])C=O)OCC

Isomeric SMILES

CCC(C)SP(=O)(N(CC1=CC(=CC=C1)[N+](=O)[O-])C=O)OCC

InChI

InChI=1S/C14H21N2O5PS/c1-4-12(3)23-22(20,21-5-2)15(11-17)10-13-7-6-8-14(9-13)16(18)19/h6-9,11-12H,4-5,10H2,1-3H3