6-isocyanatohexyl(octan-3-yl)carbamic acid

Systemtic Name: 6-isocyanatohexyl(octan-3-yl)carbamic acid Openeye Name: 1-ethylhexyl(6-isocyanatohexyl)carbamic acid CAS Name: 6-isocyanatohexyl(octan-3-yl)carbamic acid IUPAC Name: 6-isocyanatohexyl(octan-3-yl)carbamic acid Traditional Name: 1-ethylhexyl(6-isocyanatohexyl)carbamic acid Formula: C16H30N2O3 MolecularWeight: 298.421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)N(CCCCCCN=C=O)C(=O)O

Isomeric SMILES

CCCCCC(CC)N(CCCCCCN=C=O)C(=O)O

InChI

InChI=1S/C16H30N2O3/c1-3-5-8-11-15(4-2)18(16(20)21)13-10-7-6-9-12-17-14-19/h15H,3-13H2,1-2H3,(H,20,21)