1-[2-(4-methylphenoxy)-5-nitro-phenyl]sulfonyl-3-pentyl-urea

Systemtic Name: 1-[2-(4-methylphenoxy)-5-nitro-phenyl]sulfonyl-3-pentyl-urea Openeye Name: 1-[2-(4-methylphenoxy)-5-nitro-phenyl]sulfonyl-3-pentyl-urea CAS Name: 1-[2-(4-methylphenoxy)-5-nitrophenyl]sulfonyl-3-pentylurea IUPAC Name: 1-[2-(4-methylphenoxy)-5-nitrophenyl]sulfonyl-3-pentylurea Traditional Name: 1-amyl-3-[2-(4-methylphenoxy)-5-nitro-phenyl]sulfonyl-urea Formula: C19H23N3O6S MolecularWeight: 421.46742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])OC2=CC=C(C=C2)C

Isomeric SMILES

CCCCCNC(=O)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])OC2=CC=C(C=C2)C

InChI

InChI=1S/C19H23N3O6S/c1-3-4-5-12-20-19(23)21-29(26,27)18-13-15(22(24)25)8-11-17(18)28-16-9-6-14(2)7-10-16/h6-11,13H,3-5,12H2,1-2H3,(H2,20,21,23)