3-methylidene-8-oxidanylidene-7-[(2-phenyl-2-phenylmethoxy-ethanoyl)amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid

Systemtic Name: 3-methylidene-8-oxidanylidene-7-[(2-phenyl-2-phenylmethoxy-ethanoyl)amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Openeye Name: 7-[(2-benzyloxy-2-phenyl-acetyl)amino]-3-methylene-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid CAS Name: 3-methylene-8-oxo-7-[(1-oxo-2-phenyl-2-phenylmethoxyethyl)amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid IUPAC Name: 3-methylidene-8-oxo-7-[(2-phenyl-2-phenylmethoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Traditional Name: 7-[(2-benzoxy-2-phenyl-acetyl)amino]-8-keto-3-methylene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Formula: C23H22N2O5S MolecularWeight: 438.49618

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Descriptors Computed from Structure

Canonical SMILES:

C=C1CSC2C(C(=O)N2C1C(=O)O)NC(=O)C(C3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C=C1CSC2C(C(=O)N2C1C(=O)O)NC(=O)C(C3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H22N2O5S/c1-14-13-31-22-17(21(27)25(22)18(14)23(28)29)24-20(26)19(16-10-6-3-7-11-16)30-12-15-8-4-2-5-9-15/h2-11,17-19,22H,1,12-13H2,(H,24,26)(H,28,29)