1-(3-chloranyl-4-methyl-phenyl)-3-octadecyl-urea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-octadecyl-urea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-octadecyl-urea CAS Name: 1-(3-chloro-4-methylphenyl)-3-octadecylurea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-octadecylurea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-stearyl-urea Formula: C26H45ClN2O MolecularWeight: 437.1013

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)NC1=CC(=C(C=C1)C)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)NC1=CC(=C(C=C1)C)Cl

InChI

InChI=1S/C26H45ClN2O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-28-26(30)29-24-20-19-23(2)25(27)22-24/h19-20,22H,3-18,21H2,1-2H3,(H2,28,29,30)