(phenylmethyl) 6-azanyl-6-ethyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: (phenylmethyl) 6-azanyl-6-ethyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: benzyl 6-amino-6-ethyl-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-amino-6-ethyl-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-amino-6-ethyl-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-amino-6-ethyl-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzyl ester Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2N(C1=O)C(C(S2)(C)C)C(=O)OCC3=CC=CC=C3)N

Isomeric SMILES

CCC1(C2N(C1=O)C(C(S2)(C)C)C(=O)OCC3=CC=CC=C3)N

InChI

InChI=1S/C17H22N2O3S/c1-4-17(18)14(21)19-12(16(2,3)23-15(17)19)13(20)22-10-11-8-6-5-7-9-11/h5-9,12,15H,4,10,18H2,1-3H3