1-[2-ethyl-6-(2-methylpropyl)phenyl]-3-(4-nitro-2-oxidanyl-phenyl)urea

Systemtic Name: 1-[2-ethyl-6-(2-methylpropyl)phenyl]-3-(4-nitro-2-oxidanyl-phenyl)urea Openeye Name: 1-(2-ethyl-6-isobutyl-phenyl)-3-(2-hydroxy-4-nitro-phenyl)urea CAS Name: 1-[2-ethyl-6-(2-methylpropyl)phenyl]-3-(2-hydroxy-4-nitrophenyl)urea IUPAC Name: 1-[2-ethyl-6-(2-methylpropyl)phenyl]-3-(2-hydroxy-4-nitrophenyl)urea Traditional Name: 1-(2-ethyl-6-isobutyl-phenyl)-3-(2-hydroxy-4-nitro-phenyl)urea Formula: C19H23N3O4 MolecularWeight: 357.40362

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC(C)C)NC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CCC1=C(C(=CC=C1)CC(C)C)NC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C19H23N3O4/c1-4-13-6-5-7-14(10-12(2)3)18(13)21-19(24)20-16-9-8-15(22(25)26)11-17(16)23/h5-9,11-12,23H,4,10H2,1-3H3,(H2,20,21,24)