1-(2-nitro-4-oxidanyl-phenyl)-3-tetradecyl-urea

Systemtic Name: 1-(2-nitro-4-oxidanyl-phenyl)-3-tetradecyl-urea Openeye Name: 1-(4-hydroxy-2-nitro-phenyl)-3-tetradecyl-urea CAS Name: 1-(4-hydroxy-2-nitrophenyl)-3-tetradecylurea IUPAC Name: 1-(4-hydroxy-2-nitrophenyl)-3-tetradecylurea Traditional Name: 1-(4-hydroxy-2-nitro-phenyl)-3-myristyl-urea Formula: C21H35N3O4 MolecularWeight: 393.5203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCNC(=O)NC1=C(C=C(C=C1)O)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCNC(=O)NC1=C(C=C(C=C1)O)[N+](=O)[O-]

InChI

InChI=1S/C21H35N3O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-22-21(26)23-19-15-14-18(25)17-20(19)24(27)28/h14-15,17,25H,2-13,16H2,1H3,(H2,22,23,26)