dipropylphosphoryl 1-azanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: dipropylphosphoryl 1-azanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: dipropylphosphoryl 1-amino-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 1-amino-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid dipropylphosphoryl ester IUPAC Name: dipropylphosphoryl 1-amino-3,3-dimethyl-7-oxo-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 1-amino-7-keto-3,3-dimethyl-4-thia-1-azoniabicyclo[3.2.0]heptane-2-carboxylic acid dipropylphosphoryl ester Formula: C14H26N2O4PS+ MolecularWeight: 349.406001

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Descriptors Computed from Structure

Canonical SMILES:

CCCP(=O)(CCC)OC(=O)C1C(SC2[N+]1(C(=O)C2)N)(C)C

Isomeric SMILES

CCCP(=O)(CCC)OC(=O)C1C(SC2[N+]1(C(=O)C2)N)(C)C

InChI

InChI=1S/C14H26N2O4PS/c1-5-7-21(19,8-6-2)20-13(18)12-14(3,4)22-11-9-10(17)16(11,12)15/h11-12H,5-9,15H2,1-4H3/q+1