(diphenylmethyl) 6-bromanyl-3,3-dimethyl-7-oxidanylidene-6-prop-2-enyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: (diphenylmethyl) 6-bromanyl-3,3-dimethyl-7-oxidanylidene-6-prop-2-enyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: benzhydryl 6-allyl-6-bromo-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-bromo-3,3-dimethyl-7-oxo-6-prop-2-enyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 6-bromo-3,3-dimethyl-7-oxo-6-prop-2-enyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-allyl-6-bromo-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzhydryl ester Formula: C24H24BrNO3S MolecularWeight: 486.42126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)(CC=C)Br)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)(CC=C)Br)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C24H24BrNO3S/c1-4-15-24(25)21(28)26-19(23(2,3)30-22(24)26)20(27)29-18(16-11-7-5-8-12-16)17-13-9-6-10-14-17/h4-14,18-19,22H,1,15H2,2-3H3