7-[[(2E)-2-(furan-2-yl)-2-methoxyimino-ethanoyl]amino]-3-[7-(hydroxymethyl)dibenzofuran-3-yl]sulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-[[(2E)-2-(furan-2-yl)-2-methoxyimino-ethanoyl]amino]-3-[7-(hydroxymethyl)dibenzofuran-3-yl]sulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-[[(2E)-2-(2-furyl)-2-methoxyimino-acetyl]amino]-3-[7-(hydroxymethyl)dibenzofuran-3-yl]sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-[[(2E)-2-(2-furanyl)-2-methoxyimino-1-oxoethyl]amino]-3-[[7-(hydroxymethyl)-3-dibenzofuranyl]thio]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-[[(2E)-2-(furan-2-yl)-2-methoxyiminoacetyl]amino]-3-[7-(hydroxymethyl)dibenzofuran-3-yl]sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-[[(2E)-2-(2-furyl)-2-methyloximino-acetyl]amino]-8-keto-3-[(7-methyloldibenzofuran-3-yl)thio]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C27H21N3O8S2 MolecularWeight: 579.60094

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Descriptors Computed from Structure

Canonical SMILES:

CON=C(C1=CC=CO1)C(=O)NC2C3N(C2=O)C(=C(CS3)SC4=CC5=C(C=C4)C6=C(O5)C=C(C=C6)CO)C(=O)O

Isomeric SMILES

CO/N=C(\C1=CC=CO1)/C(=O)NC2C3N(C2=O)C(=C(CS3)SC4=CC5=C(C=C4)C6=C(O5)C=C(C=C6)CO)C(=O)O

InChI

InChI=1S/C27H21N3O8S2/c1-36-29-21(17-3-2-8-37-17)24(32)28-22-25(33)30-23(27(34)35)20(12-39-26(22)30)40-14-5-7-16-15-6-4-13(11-31)9-18(15)38-19(16)10-14/h2-10,22,26,31H,11-12H2,1H3,(H,28,32)(H,34,35)/b29-21+