hexyl(1-isocyanatobutyl)carbamic acid

Systemtic Name: hexyl(1-isocyanatobutyl)carbamic acid Openeye Name: hexyl(1-isocyanatobutyl)carbamic acid CAS Name: hexyl(1-isocyanatobutyl)carbamic acid IUPAC Name: hexyl(1-isocyanatobutyl)carbamic acid Traditional Name: hexyl(1-isocyanatobutyl)carbamic acid Formula: C12H22N2O3 MolecularWeight: 242.31468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C(CCC)N=C=O)C(=O)O

Isomeric SMILES

CCCCCCN(C(CCC)N=C=O)C(=O)O

InChI

InChI=1S/C12H22N2O3/c1-3-5-6-7-9-14(12(16)17)11(8-4-2)13-10-15/h11H,3-9H2,1-2H3,(H,16,17)