but-3-yn-2-yl N-(3-chlorophenyl)carbamate; 3-cyclooctyl-1,1-dimethyl-urea

Systemtic Name: but-3-yn-2-yl N-(3-chlorophenyl)carbamate; 3-cyclooctyl-1,1-dimethyl-urea Openeye Name: 3-cyclooctyl-1,1-dimethyl-urea; 1-methylprop-2-ynyl N-(3-chlorophenyl)carbamate CAS Name: N-(3-chlorophenyl)carbamic acid but-3-yn-2-yl ester; 3-cyclooctyl-1,1-dimethylurea IUPAC Name: but-3-yn-2-yl N-(3-chlorophenyl)carbamate; 3-cyclooctyl-1,1-dimethylurea Traditional Name: N-(3-chlorophenyl)carbamic acid 1-methylprop-2-ynyl ester; 3-cyclooctyl-1,1-dimethyl-urea Formula: C22H32ClN3O3 MolecularWeight: 421.96078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#C)OC(=O)NC1=CC(=CC=C1)Cl.CN(C)C(=O)NC1CCCCCCC1

Isomeric SMILES

CC(C#C)OC(=O)NC1=CC(=CC=C1)Cl.CN(C)C(=O)NC1CCCCCCC1

InChI

InChI=1S/C11H10ClNO2.C11H22N2O/c1-3-8(2)15-11(14)13-10-6-4-5-9(12)7-10;1-13(2)11(14)12-10-8-6-4-3-5-7-9-10/h1,4-8H,2H3,(H,13,14);10H,3-9H2,1-2H3,(H,12,14)