3-(3-chloranyl-4-methyl-phenyl)-1-hexadecyl-1-(phenylmethyl)urea

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-1-hexadecyl-1-(phenylmethyl)urea Openeye Name: 1-benzyl-3-(3-chloro-4-methyl-phenyl)-1-hexadecyl-urea CAS Name: 3-(3-chloro-4-methylphenyl)-1-hexadecyl-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-(3-chloro-4-methylphenyl)-1-hexadecylurea Traditional Name: 1-benzyl-1-cetyl-3-(3-chloro-4-methyl-phenyl)urea Formula: C31H47ClN2O MolecularWeight: 499.17068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN(CC1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2)C)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCN(CC1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2)C)Cl

InChI

InChI=1S/C31H47ClN2O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24-34(26-28-20-17-16-18-21-28)31(35)33-29-23-22-27(2)30(32)25-29/h16-18,20-23,25H,3-15,19,24,26H2,1-2H3,(H,33,35)