(phenylmethyl) 6-azanyl-7-oxidanylidene-6-(2-phenoxyethanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: (phenylmethyl) 6-azanyl-7-oxidanylidene-6-(2-phenoxyethanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: benzyl 6-amino-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-amino-7-oxo-6-[(1-oxo-2-phenoxyethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-amino-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-amino-7-keto-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzyl ester Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N2C(S1)C(C2=O)(N)NC(=O)COC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1C(N2C(S1)C(C2=O)(N)NC(=O)COC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O5S/c22-21(23-17(25)12-28-15-9-5-2-6-10-15)19(27)24-16(13-30-20(21)24)18(26)29-11-14-7-3-1-4-8-14/h1-10,16,20H,11-13,22H2,(H,23,25)