1-[[3-[4-(1-butoxy-2-methyl-propan-2-yl)-2-oxidanyl-phenyl]phenyl]methyl]-3-propyl-urea

Systemtic Name: 1-[[3-[4-(1-butoxy-2-methyl-propan-2-yl)-2-oxidanyl-phenyl]phenyl]methyl]-3-propyl-urea Openeye Name: 1-[[3-[4-(2-butoxy-1,1-dimethyl-ethyl)-2-hydroxy-phenyl]phenyl]methyl]-3-propyl-urea CAS Name: 1-[[3-[4-(1-butoxy-2-methylpropan-2-yl)-2-hydroxyphenyl]phenyl]methyl]-3-propylurea IUPAC Name: 1-[[3-[4-(1-butoxy-2-methylpropan-2-yl)-2-hydroxyphenyl]phenyl]methyl]-3-propylurea Traditional Name: 1-[3-[4-(2-butoxy-1,1-dimethyl-ethyl)-2-hydroxy-phenyl]benzyl]-3-propyl-urea Formula: C25H36N2O3 MolecularWeight: 412.56494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(C)(C)C1=CC(=C(C=C1)C2=CC(=CC=C2)CNC(=O)NCCC)O

Isomeric SMILES

CCCCOCC(C)(C)C1=CC(=C(C=C1)C2=CC(=CC=C2)CNC(=O)NCCC)O

InChI

InChI=1S/C25H36N2O3/c1-5-7-14-30-18-25(3,4)21-11-12-22(23(28)16-21)20-10-8-9-19(15-20)17-27-24(29)26-13-6-2/h8-12,15-16,28H,5-7,13-14,17-18H2,1-4H3,(H2,26,27,29)