1-but-3-yn-2-yl-3-(4-chlorophenyl)-1-methyl-urea

Systemtic Name: 1-but-3-yn-2-yl-3-(4-chlorophenyl)-1-methyl-urea Openeye Name: 3-(4-chlorophenyl)-1-methyl-1-(1-methylprop-2-ynyl)urea CAS Name: 1-but-3-yn-2-yl-3-(4-chlorophenyl)-1-methylurea IUPAC Name: 1-but-3-yn-2-yl-3-(4-chlorophenyl)-1-methylurea Traditional Name: 3-(4-chlorophenyl)-1-methyl-1-(1-methylprop-2-ynyl)urea Formula: C12H13ClN2O MolecularWeight: 236.69742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C#C)N(C)C(=O)NC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C#C)N(C)C(=O)NC1=CC=C(C=C1)Cl

InChI

InChI=1S/C12H13ClN2O/c1-4-9(2)15(3)12(16)14-11-7-5-10(13)6-8-11/h1,5-9H,2-3H3,(H,14,16)