prop-2-enyl (5S,6S)-6-[(1R)-1-hexadecanoyloxyethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: prop-2-enyl (5S,6S)-6-[(1R)-1-hexadecanoyloxyethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: allyl (5S,6S)-6-[(1R)-1-hexadecanoyloxyethyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: (5S,6S)-7-oxo-6-[(1R)-1-(1-oxohexadecoxy)ethyl]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (5S,6S)-6-[(1R)-1-hexadecanoyloxyethyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: (5S,6S)-6-[(1R)-1-hexadecanoyloxyethyl]-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid allyl ester Formula: C27H43NO5S MolecularWeight: 493.69902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC(C)C1C2N(C1=O)C(=CS2)C(=O)OCC=C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)O[C@H](C)[C@@H]1[C@H]2N(C1=O)C(=CS2)C(=O)OCC=C

InChI

InChI=1S/C27H43NO5S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-23(29)33-21(3)24-25(30)28-22(20-34-26(24)28)27(31)32-19-5-2/h5,20-21,24,26H,2,4,6-19H2,1,3H3/t21-,24+,26+/m1/s1