1-(1,3-benzodioxol-5-yl)-3-[2-(4-methyl-2-nitro-phenoxy)ethanoylamino]urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-methyl-2-nitro-phenoxy)ethanoylamino]urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[[2-(4-methyl-2-nitro-phenoxy)acetyl]amino]urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[[2-(4-methyl-2-nitrophenoxy)-1-oxoethyl]amino]urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[[2-(4-methyl-2-nitrophenoxy)acetyl]amino]urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[[2-(4-methyl-2-nitro-phenoxy)acetyl]amino]urea Formula: C17H16N4O7 MolecularWeight: 388.33154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NNC(=O)NC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NNC(=O)NC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O7/c1-10-2-4-13(12(6-10)21(24)25)26-8-16(22)19-20-17(23)18-11-3-5-14-15(7-11)28-9-27-14/h2-7H,8-9H2,1H3,(H,19,22)(H2,18,20,23)