[(1S,4R,5R,6R)-5,6-diacetyloxy-4-(trimethylazaniumyl)cyclohex-2-en-1-yl]-trimethyl-azanium

Systemtic Name: [(1S,4R,5R,6R)-5,6-diacetyloxy-4-(trimethylazaniumyl)cyclohex-2-en-1-yl]-trimethyl-azanium Openeye Name: [(1S,4R,5R,6R)-5,6-diacetoxy-4-(trimethylammonio)cyclohex-2-en-1-yl]-trimethyl-ammonium CAS Name: [(1S,4R,5R,6R)-5,6-diacetyloxy-4-(trimethylammonio)-1-cyclohex-2-enyl]-trimethylammonium IUPAC Name: [(1S,4R,5R,6R)-5,6-diacetyloxy-4-(trimethylazaniumyl)cyclohex-2-en-1-yl]-trimethylazanium Traditional Name: [(1S,4R,5R,6R)-5,6-diacetoxy-4-(trimethylammonio)cyclohex-2-en-1-yl]-trimethyl-ammonium Formula: C16H30N2O4+2 MolecularWeight: 314.4204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C=CC(C1OC(=O)C)[N+](C)(C)C)[N+](C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H30N2O4/c1-11(19)21-15-13(17(3,4)5)9-10-14(18(6,7)8)16(15)22-12(2)20/h9-10,13-16H,1-8H3/q+2/t13-,14+,15-,16-/m1/s1