1,1-dimethyl-3-(3-morpholin-4-ylpropyl)-3-[(5-nitro-2-oxidanyl-phenyl)methyl]urea

Systemtic Name: 1,1-dimethyl-3-(3-morpholin-4-ylpropyl)-3-[(5-nitro-2-oxidanyl-phenyl)methyl]urea Openeye Name: 1-[(2-hydroxy-5-nitro-phenyl)methyl]-3,3-dimethyl-1-(3-morpholinopropyl)urea CAS Name: 1-[(2-hydroxy-5-nitrophenyl)methyl]-3,3-dimethyl-1-[3-(4-morpholinyl)propyl]urea IUPAC Name: 1-[(2-hydroxy-5-nitrophenyl)methyl]-3,3-dimethyl-1-(3-morpholin-4-ylpropyl)urea Traditional Name: 1-(2-hydroxy-5-nitro-benzyl)-3,3-dimethyl-1-(3-morpholinopropyl)urea Formula: C17H26N4O5 MolecularWeight: 366.41214

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N(CCCN1CCOCC1)CC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CN(C)C(=O)N(CCCN1CCOCC1)CC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C17H26N4O5/c1-18(2)17(23)20(7-3-6-19-8-10-26-11-9-19)13-14-12-15(21(24)25)4-5-16(14)22/h4-5,12,22H,3,6-11,13H2,1-2H3