1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxy-2-nitro-phenyl)-1-methyl-urea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxy-2-nitro-phenyl)-1-methyl-urea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxy-2-nitro-phenyl)-1-methyl-urea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxy-2-nitrophenyl)-1-methylurea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxy-2-nitrophenyl)-1-methylurea Traditional Name: 3-(4-methoxy-2-nitro-phenyl)-1-methyl-1-piperonyl-urea Formula: C17H17N3O6 MolecularWeight: 359.33338

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)C(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)C(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O6/c1-19(9-11-3-6-15-16(7-11)26-10-25-15)17(21)18-13-5-4-12(24-2)8-14(13)20(22)23/h3-8H,9-10H2,1-2H3,(H,18,21)