anthracen-1-ylmethyl (3E)-7-oxidanylidene-3-(4-sulfanylidenebutan-2-ylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: anthracen-1-ylmethyl (3E)-7-oxidanylidene-3-(4-sulfanylidenebutan-2-ylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: 1-anthrylmethyl (3E)-3-(1-methyl-3-thioxo-propylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: (3E)-7-oxo-3-(4-sulfanylidenebutan-2-ylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 1-anthracenylmethyl ester IUPAC Name: anthracen-1-ylmethyl (3E)-7-oxo-3-(4-sulfanylidenebutan-2-ylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: (3E)-7-keto-3-(1-methyl-3-thioxo-propylidene)-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 1-anthrylmethyl ester Formula: C25H21NO4S MolecularWeight: 431.50354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(N2C(O1)CC2=O)C(=O)OCC3=CC=CC4=CC5=CC=CC=C5C=C43)CC=S

Isomeric SMILES

C/C(=C\1/C(N2C(O1)CC2=O)C(=O)OCC3=CC=CC4=CC5=CC=CC=C5C=C43)/CC=S

InChI

InChI=1S/C25H21NO4S/c1-15(9-10-31)24-23(26-21(27)13-22(26)30-24)25(28)29-14-19-8-4-7-18-11-16-5-2-3-6-17(16)12-20(18)19/h2-8,10-12,22-23H,9,13-14H2,1H3/b24-15+