methyl (1S,3R)-3-isocyanato-2,2,3-trimethyl-cyclopentane-1-carboxylate

Systemtic Name: methyl (1S,3R)-3-isocyanato-2,2,3-trimethyl-cyclopentane-1-carboxylate Openeye Name: methyl (1S,3R)-3-isocyanato-2,2,3-trimethyl-cyclopentanecarboxylate CAS Name: (1S,3R)-3-isocyanato-2,2,3-trimethyl-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl (1S,3R)-3-isocyanato-2,2,3-trimethylcyclopentane-1-carboxylate Traditional Name: (1S,3R)-3-isocyanato-2,2,3-trimethyl-cyclopentanecarboxylic acid methyl ester Formula: C11H17NO3 MolecularWeight: 211.25758

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1(C)N=C=O)C(=O)OC)C

Isomeric SMILES

C[C@]1(CC[C@@H](C1(C)C)C(=O)OC)N=C=O

InChI

InChI=1S/C11H17NO3/c1-10(2)8(9(14)15-4)5-6-11(10,3)12-7-13/h8H,5-6H2,1-4H3/t8-,11-/m1/s1