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3-isocyanatoadamantane-1-carboxylic acid

3-isocyanatoadamantane-1-carboxylic acid

Systemtic Name:3-isocyanatoadamantane-1-carboxylic acid
Openeye Name:3-isocyanatoadamantane-1-carboxylic acid
CAS Name:3-isocyanato-1-adamantanecarboxylic acid
IUPAC Name:3-isocyanatoadamantane-1-carboxylic acid
Traditional Name:3-isocyanatoadamantane-1-carboxylic acid
Formula: C12H15NO3
MolecularWeight: 221.2524
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)N=C=O)C(=O)O


Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)N=C=O)C(=O)O


InChI

InChI=1S/C12H15NO3/c14-7-13-12-4-8-1-9(5-12)3-11(2-8,6-12)10(15)16/h8-9H,1-6H2,(H,15,16)


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