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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-dimethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-1,3-oxazol-5-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-dimethoxyphosphoryl-2-[(4-nitrophenyl)methyl]oxazol-5-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-dimethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-5-oxazolamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-dimethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-1,3-oxazol-5-amine Traditional Name: [4-dimethoxyphosphoryl-2-(4-nitrobenzyl)oxazol-5-yl]-piperonyl-amine Formula: C20H20N3O8P MolecularWeight: 461.361861

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N3O8P/c1-27-32(26,28-2)20-19(21-11-14-5-8-16-17(9-14)30-12-29-16)31-18(22-20)10-13-3-6-15(7-4-13)23(24)25/h3-9,21H,10-12H2,1-2H3