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1-(4-nitrophenyl)-3-[(9E,12E)-octadeca-9,12-dienyl]urea

1-(4-nitrophenyl)-3-[(9E,12E)-octadeca-9,12-dienyl]urea

Systemtic Name:1-(4-nitrophenyl)-3-[(9E,12E)-octadeca-9,12-dienyl]urea
Openeye Name:1-(4-nitrophenyl)-3-[(9E,12E)-octadeca-9,12-dienyl]urea
CAS Name:1-(4-nitrophenyl)-3-[(9E,12E)-octadeca-9,12-dienyl]urea
IUPAC Name:1-(4-nitrophenyl)-3-[(9E,12E)-octadeca-9,12-dienyl]urea
Traditional Name:1-(4-nitrophenyl)-3-[(9E,12E)-octadeca-9,12-dienyl]urea
Formula: C25H39N3O3
MolecularWeight: 429.59546
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCCNC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]


Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCCNC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]


InChI

InChI=1S/C25H39N3O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-26-25(29)27-23-18-20-24(21-19-23)28(30)31/h6-7,9-10,18-21H,2-5,8,11-17,22H2,1H3,(H2,26,27,29)/b7-6+,10-9+


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