sodium 7-oxidanylidene-3-phenyl-6-(2-phenylethanoylamino)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: sodium 7-oxidanylidene-3-phenyl-6-(2-phenylethanoylamino)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: sodium 7-oxo-3-phenyl-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: sodium 7-oxo-6-[(1-oxo-2-phenylethyl)amino]-3-phenyl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: sodium 7-oxo-3-phenyl-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: sodium 7-keto-3-phenyl-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C20H15N2NaO4S MolecularWeight: 402.39887

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC2C3N(C2=O)C(=C(S3)C4=CC=CC=C4)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC2C3N(C2=O)C(=C(S3)C4=CC=CC=C4)C(=O)[O-].[Na+]

InChI

InChI=1S/C20H16N2O4S.Na/c23-14(11-12-7-3-1-4-8-12)21-15-18(24)22-16(20(25)26)17(27-19(15)22)13-9-5-2-6-10-13;/h1-10,15,19H,11H2,(H,21,23)(H,25,26);/q;+1/p-1