3-[4-[4-(3,5-dimethylphenoxy)but-2-ynoxy]phenyl]-1,1-dimethyl-urea

Systemtic Name: 3-[4-[4-(3,5-dimethylphenoxy)but-2-ynoxy]phenyl]-1,1-dimethyl-urea Openeye Name: 3-[4-[4-(3,5-dimethylphenoxy)but-2-ynoxy]phenyl]-1,1-dimethyl-urea CAS Name: 3-[4-[4-(3,5-dimethylphenoxy)but-2-ynoxy]phenyl]-1,1-dimethylurea IUPAC Name: 3-[4-[4-(3,5-dimethylphenoxy)but-2-ynoxy]phenyl]-1,1-dimethylurea Traditional Name: 3-[4-[4-(3,5-dimethylphenoxy)but-2-ynoxy]phenyl]-1,1-dimethyl-urea Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC#CCOC2=CC=C(C=C2)NC(=O)N(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC#CCOC2=CC=C(C=C2)NC(=O)N(C)C)C

InChI

InChI=1S/C21H24N2O3/c1-16-13-17(2)15-20(14-16)26-12-6-5-11-25-19-9-7-18(8-10-19)22-21(24)23(3)4/h7-10,13-15H,11-12H2,1-4H3,(H,22,24)