N-(1,3-benzodioxol-5-ylmethyl)-4-diethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-1,3-oxazol-5-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-diethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-1,3-oxazol-5-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-diethoxyphosphoryl-2-[(4-nitrophenyl)methyl]oxazol-5-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-diethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-5-oxazolamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-diethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-1,3-oxazol-5-amine Traditional Name: [4-diethoxyphosphoryl-2-(4-nitrobenzyl)oxazol-5-yl]-piperonyl-amine Formula: C22H24N3O8P MolecularWeight: 489.415021

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C(OC(=N1)CC2=CC=C(C=C2)[N+](=O)[O-])NCC3=CC4=C(C=C3)OCO4)OCC

Isomeric SMILES

CCOP(=O)(C1=C(OC(=N1)CC2=CC=C(C=C2)[N+](=O)[O-])NCC3=CC4=C(C=C3)OCO4)OCC

InChI

InChI=1S/C22H24N3O8P/c1-3-31-34(28,32-4-2)22-21(23-13-16-7-10-18-19(11-16)30-14-29-18)33-20(24-22)12-15-5-8-17(9-6-15)25(26)27/h5-11,23H,3-4,12-14H2,1-2H3