potassium (5R,6S)-6-(hydroxymethyl)-3-(3-iodanyl-5-phenyl-phenyl)-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: potassium (5R,6S)-6-(hydroxymethyl)-3-(3-iodanyl-5-phenyl-phenyl)-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: potassium (5R,6S)-6-(hydroxymethyl)-3-(3-iodo-5-phenyl-phenyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: potassium (5R,6S)-6-(hydroxymethyl)-3-(3-iodo-5-phenylphenyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: potassium (5R,6S)-6-(hydroxymethyl)-3-(3-iodo-5-phenylphenyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: potassium (5R,6S)-3-(3-iodo-5-phenyl-phenyl)-7-keto-6-methylol-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C20H15IKNO4 MolecularWeight: 499.34017

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(C(=O)N2C(=C1C3=CC(=CC(=C3)C4=CC=CC=C4)I)C(=O)[O-])CO.[K+]

Isomeric SMILES

C1[C@@H]2[C@H](C(=O)N2C(=C1C3=CC(=CC(=C3)C4=CC=CC=C4)I)C(=O)[O-])CO.[K+]

InChI

InChI=1S/C20H16INO4.K/c21-14-7-12(11-4-2-1-3-5-11)6-13(8-14)15-9-17-16(10-23)19(24)22(17)18(15)20(25)26;/h1-8,16-17,23H,9-10H2,(H,25,26);/q;+1/p-1/t16-,17-;/m1./s1