1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-hexyl-urea

Systemtic Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-hexyl-urea Openeye Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-hexyl-urea CAS Name: 1-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-hexylurea IUPAC Name: 1-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-hexylurea Traditional Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-hexyl-urea Formula: C17H27N3O5 MolecularWeight: 353.41338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)NCCC1=CC(=C(C=C1[N+](=O)[O-])OC)OC

Isomeric SMILES

CCCCCCNC(=O)NCCC1=CC(=C(C=C1[N+](=O)[O-])OC)OC

InChI

InChI=1S/C17H27N3O5/c1-4-5-6-7-9-18-17(21)19-10-8-13-11-15(24-2)16(25-3)12-14(13)20(22)23/h11-12H,4-10H2,1-3H3,(H2,18,19,21)