1-[(4-butoxyphenyl)methyl]-3-(4-chloranyl-2-methyl-phenyl)-1-heptyl-urea

Systemtic Name: 1-[(4-butoxyphenyl)methyl]-3-(4-chloranyl-2-methyl-phenyl)-1-heptyl-urea Openeye Name: 1-[(4-butoxyphenyl)methyl]-3-(4-chloro-2-methyl-phenyl)-1-heptyl-urea CAS Name: 1-[(4-butoxyphenyl)methyl]-3-(4-chloro-2-methylphenyl)-1-heptylurea IUPAC Name: 1-[(4-butoxyphenyl)methyl]-3-(4-chloro-2-methylphenyl)-1-heptylurea Traditional Name: 1-(4-butoxybenzyl)-3-(4-chloro-2-methyl-phenyl)-1-heptyl-urea Formula: C26H37ClN2O2 MolecularWeight: 445.03718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CC1=CC=C(C=C1)OCCCC)C(=O)NC2=C(C=C(C=C2)Cl)C

Isomeric SMILES

CCCCCCCN(CC1=CC=C(C=C1)OCCCC)C(=O)NC2=C(C=C(C=C2)Cl)C

InChI

InChI=1S/C26H37ClN2O2/c1-4-6-8-9-10-17-29(26(30)28-25-16-13-23(27)19-21(25)3)20-22-11-14-24(15-12-22)31-18-7-5-2/h11-16,19H,4-10,17-18,20H2,1-3H3,(H,28,30)