(3,3-dimethyl-7-oxidanylidene-2-phenylmethoxycarbonyl-4-thia-1-azabicyclo[3.2.0]heptan-6-ylidene)-(phenylmethylidene)azanium

Systemtic Name: (3,3-dimethyl-7-oxidanylidene-2-phenylmethoxycarbonyl-4-thia-1-azabicyclo[3.2.0]heptan-6-ylidene)-(phenylmethylidene)azanium Openeye Name: benzylidene-(2-benzyloxycarbonyl-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptan-6-ylidene)ammonium CAS Name: (3,3-dimethyl-7-oxo-2-phenylmethoxycarbonyl-4-thia-1-azabicyclo[3.2.0]heptan-6-ylidene)-(phenylmethylene)ammonium IUPAC Name: benzylidene-(3,3-dimethyl-7-oxo-2-phenylmethoxycarbonyl-4-thia-1-azabicyclo[3.2.0]heptan-6-ylidene)azanium Traditional Name: benzal-(2-carbobenzoxy-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptan-6-ylidene)ammonium Formula: C22H21N2O3S+ MolecularWeight: 393.47874

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(=[N+]=CC3=CC=CC=C3)C2=O)C(=O)OCC4=CC=CC=C4)C

Isomeric SMILES

CC1(C(N2C(S1)C(=[N+]=CC3=CC=CC=C3)C2=O)C(=O)OCC4=CC=CC=C4)C

InChI

InChI=1S/C22H21N2O3S/c1-22(2)18(21(26)27-14-16-11-7-4-8-12-16)24-19(25)17(20(24)28-22)23-13-15-9-5-3-6-10-15/h3-13,18,20H,14H2,1-2H3/q+1