(5R,6S)-3-(4-carbamimidoyldibenzofuran-2-yl)-6-[(1R)-1-oxidanylethyl]-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: (5R,6S)-3-(4-carbamimidoyldibenzofuran-2-yl)-6-[(1R)-1-oxidanylethyl]-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: (5R,6S)-3-(4-carbamimidoyldibenzofuran-2-yl)-6-[(1R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: (5R,6S)-3-(4-carbamimidoyl-2-dibenzofuranyl)-6-[(1R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: (5R,6S)-3-(4-carbamimidoyldibenzofuran-2-yl)-6-[(1R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: (5R,6S)-3-(4-amidinodibenzofuran-2-yl)-6-[(1R)-1-hydroxyethyl]-7-keto-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C22H19N3O5 MolecularWeight: 405.40336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2CC(=C(N2C1=O)C(=O)O)C3=CC(=C4C(=C3)C5=CC=CC=C5O4)C(=N)N)O

Isomeric SMILES

C[C@H]([C@@H]1[C@H]2CC(=C(N2C1=O)C(=O)O)C3=CC(=C4C(=C3)C5=CC=CC=C5O4)C(=N)N)O

InChI

InChI=1S/C22H19N3O5/c1-9(26)17-15-8-12(18(22(28)29)25(15)21(17)27)10-6-13-11-4-2-3-5-16(11)30-19(13)14(7-10)20(23)24/h2-7,9,15,17,26H,8H2,1H3,(H3,23,24)(H,28,29)/t9-,15-,17-/m1/s1