1-[2-[[3-(2-cyanophenoxy)-2-oxidanyl-propyl]amino]ethyl]-3-(2-nitrophenyl)urea

Systemtic Name: 1-[2-[[3-(2-cyanophenoxy)-2-oxidanyl-propyl]amino]ethyl]-3-(2-nitrophenyl)urea Openeye Name: 1-[2-[[3-(2-cyanophenoxy)-2-hydroxy-propyl]amino]ethyl]-3-(2-nitrophenyl)urea CAS Name: 1-[2-[[3-(2-cyanophenoxy)-2-hydroxypropyl]amino]ethyl]-3-(2-nitrophenyl)urea IUPAC Name: 1-[2-[[3-(2-cyanophenoxy)-2-hydroxypropyl]amino]ethyl]-3-(2-nitrophenyl)urea Traditional Name: 1-[2-[[3-(2-cyanophenoxy)-2-hydroxy-propyl]amino]ethyl]-3-(2-nitrophenyl)urea Formula: C19H21N5O5 MolecularWeight: 399.40054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)OCC(CNCCNC(=O)NC2=CC=CC=C2[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C(=C1)C#N)OCC(CNCCNC(=O)NC2=CC=CC=C2[N+](=O)[O-])O

InChI

InChI=1S/C19H21N5O5/c20-11-14-5-1-4-8-18(14)29-13-15(25)12-21-9-10-22-19(26)23-16-6-2-3-7-17(16)24(27)28/h1-8,15,21,25H,9-10,12-13H2,(H2,22,23,26)