7-benzamido-3-(ethoxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 7-benzamido-3-(ethoxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 7-benzamido-3-(ethoxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-benzamido-3-(ethoxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: 7-benzamido-3-(ethoxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-benzamido-3-(ethoxymethyl)-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C17H17N2O5S- MolecularWeight: 361.39228

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(N2C(C(C2=O)NC(=O)C3=CC=CC=C3)SC1)C(=O)[O-]

Isomeric SMILES

CCOCC1=C(N2C(C(C2=O)NC(=O)C3=CC=CC=C3)SC1)C(=O)[O-]

InChI

InChI=1S/C17H18N2O5S/c1-2-24-8-11-9-25-16-12(15(21)19(16)13(11)17(22)23)18-14(20)10-6-4-3-5-7-10/h3-7,12,16H,2,8-9H2,1H3,(H,18,20)(H,22,23)/p-1