1-[(3-fluoranyl-4-methyl-phenyl)methyl]-3-[2-[(4-nitrophenyl)amino]ethyl]urea

Systemtic Name: 1-[(3-fluoranyl-4-methyl-phenyl)methyl]-3-[2-[(4-nitrophenyl)amino]ethyl]urea Openeye Name: 1-[(3-fluoro-4-methyl-phenyl)methyl]-3-[2-(4-nitroanilino)ethyl]urea CAS Name: 1-[(3-fluoro-4-methylphenyl)methyl]-3-[2-(4-nitroanilino)ethyl]urea IUPAC Name: 1-[(3-fluoro-4-methylphenyl)methyl]-3-[2-(4-nitroanilino)ethyl]urea Traditional Name: 1-(3-fluoro-4-methyl-benzyl)-3-[2-(4-nitroanilino)ethyl]urea Formula: C17H19FN4O3 MolecularWeight: 346.356163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-])F

InChI

InChI=1S/C17H19FN4O3/c1-12-2-3-13(10-16(12)18)11-21-17(23)20-9-8-19-14-4-6-15(7-5-14)22(24)25/h2-7,10,19H,8-9,11H2,1H3,(H2,20,21,23)