N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethoxyphenyl)-4-dimethoxyphosphoryl-1,3-oxazol-5-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethoxyphenyl)-4-dimethoxyphosphoryl-1,3-oxazol-5-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethoxyphenyl)-4-dimethoxyphosphoryl-oxazol-5-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethoxyphenyl)-4-dimethoxyphosphoryl-5-oxazolamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethoxyphenyl)-4-dimethoxyphosphoryl-1,3-oxazol-5-amine Traditional Name: [2-(3,4-dimethoxyphenyl)-4-dimethoxyphosphoryl-oxazol-5-yl]-piperonyl-amine Formula: C21H23N2O8P MolecularWeight: 462.389681

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=C(O2)NCC3=CC4=C(C=C3)OCO4)P(=O)(OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=C(O2)NCC3=CC4=C(C=C3)OCO4)P(=O)(OC)OC)OC

InChI

InChI=1S/C21H23N2O8P/c1-25-15-8-6-14(10-17(15)26-2)19-23-21(32(24,27-3)28-4)20(31-19)22-11-13-5-7-16-18(9-13)30-12-29-16/h5-10,22H,11-12H2,1-4H3