(1S,2R,4S)-5-(aminomethyl)-2,4-bis(chloranyl)-1-methyl-8-oxabicyclo[3.2.1]octan-3-one hydrochloride

Systemtic Name: (1S,2R,4S)-5-(aminomethyl)-2,4-bis(chloranyl)-1-methyl-8-oxabicyclo[3.2.1]octan-3-one hydrochloride Openeye Name: (1S,2R,4S)-5-(aminomethyl)-2,4-dichloro-1-methyl-8-oxabicyclo[3.2.1]octan-3-one hydrochloride CAS Name: (1S,2R,4S)-5-(aminomethyl)-2,4-dichloro-1-methyl-8-oxabicyclo[3.2.1]octan-3-one hydrochloride IUPAC Name: (1S,2R,4S)-5-(aminomethyl)-2,4-dichloro-1-methyl-8-oxabicyclo[3.2.1]octan-3-one hydrochloride Traditional Name: (1S,2R,4S)-5-(aminomethyl)-2,4-dichloro-1-methyl-8-oxabicyclo[3.2.1]octan-3-one hydrochloride Formula: C9H14Cl3NO2 MolecularWeight: 274.57196

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(O1)(C(C(=O)C2Cl)Cl)CN.Cl

Isomeric SMILES

C[C@@]12CCC(O1)([C@@H](C(=O)[C@@H]2Cl)Cl)CN.Cl

InChI

InChI=1S/C9H13Cl2NO2.ClH/c1-8-2-3-9(4-12,14-8)7(11)5(13)6(8)10;/h6-7H,2-4,12H2,1H3;1H/t6-,7+,8-,9?;/m0./s1