1-butyl-3-(2,4-dimethylphenyl)-1-[(4-heptoxyphenyl)methyl]urea

Systemtic Name: 1-butyl-3-(2,4-dimethylphenyl)-1-[(4-heptoxyphenyl)methyl]urea Openeye Name: 1-butyl-3-(2,4-dimethylphenyl)-1-[(4-heptoxyphenyl)methyl]urea CAS Name: 1-butyl-3-(2,4-dimethylphenyl)-1-[(4-heptoxyphenyl)methyl]urea IUPAC Name: 1-butyl-3-(2,4-dimethylphenyl)-1-[(4-heptoxyphenyl)methyl]urea Traditional Name: 1-butyl-3-(2,4-dimethylphenyl)-1-(4-heptoxybenzyl)urea Formula: C27H40N2O2 MolecularWeight: 424.6187

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)CN(CCCC)C(=O)NC2=C(C=C(C=C2)C)C

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)CN(CCCC)C(=O)NC2=C(C=C(C=C2)C)C

InChI

InChI=1S/C27H40N2O2/c1-5-7-9-10-11-19-31-25-15-13-24(14-16-25)21-29(18-8-6-2)27(30)28-26-17-12-22(3)20-23(26)4/h12-17,20H,5-11,18-19,21H2,1-4H3,(H,28,30)