4-diethoxyphosphoryl-N-[2-(4-methoxyphenyl)ethyl]-2-(3-nitrophenyl)-1,3-oxazol-5-amine

Systemtic Name: 4-diethoxyphosphoryl-N-[2-(4-methoxyphenyl)ethyl]-2-(3-nitrophenyl)-1,3-oxazol-5-amine Openeye Name: 4-diethoxyphosphoryl-N-[2-(4-methoxyphenyl)ethyl]-2-(3-nitrophenyl)oxazol-5-amine CAS Name: 4-diethoxyphosphoryl-N-[2-(4-methoxyphenyl)ethyl]-2-(3-nitrophenyl)-5-oxazolamine IUPAC Name: 4-diethoxyphosphoryl-N-[2-(4-methoxyphenyl)ethyl]-2-(3-nitrophenyl)-1,3-oxazol-5-amine Traditional Name: [4-diethoxyphosphoryl-2-(3-nitrophenyl)oxazol-5-yl]-[2-(4-methoxyphenyl)ethyl]amine Formula: C22H26N3O7P MolecularWeight: 475.431501

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C(OC(=N1)C2=CC(=CC=C2)[N+](=O)[O-])NCCC3=CC=C(C=C3)OC)OCC

Isomeric SMILES

CCOP(=O)(C1=C(OC(=N1)C2=CC(=CC=C2)[N+](=O)[O-])NCCC3=CC=C(C=C3)OC)OCC

InChI

InChI=1S/C22H26N3O7P/c1-4-30-33(28,31-5-2)22-21(23-14-13-16-9-11-19(29-3)12-10-16)32-20(24-22)17-7-6-8-18(15-17)25(26)27/h6-12,15,23H,4-5,13-14H2,1-3H3