7-[[2-(4-hydroxyphenyl)-3-oxidanyl-3-oxidanylidene-propanoyl]amino]-7-methoxy-3-methyl-8-oxidanylidene-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-[[2-(4-hydroxyphenyl)-3-oxidanyl-3-oxidanylidene-propanoyl]amino]-7-methoxy-3-methyl-8-oxidanylidene-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-[[3-hydroxy-2-(4-hydroxyphenyl)-3-oxo-propanoyl]amino]-7-methoxy-3-methyl-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-[[3-hydroxy-2-(4-hydroxyphenyl)-1,3-dioxopropyl]amino]-7-methoxy-3-methyl-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-[[3-hydroxy-2-(4-hydroxyphenyl)-3-oxopropanoyl]amino]-7-methoxy-3-methyl-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-[[3-hydroxy-2-(4-hydroxyphenyl)-3-keto-propanoyl]amino]-8-keto-7-methoxy-3-methyl-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C18H18N2O9 MolecularWeight: 406.34352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)(NC(=O)C(C3=CC=C(C=C3)O)C(=O)O)OC)OC1)C(=O)O

Isomeric SMILES

CC1=C(N2C(C(C2=O)(NC(=O)C(C3=CC=C(C=C3)O)C(=O)O)OC)OC1)C(=O)O

InChI

InChI=1S/C18H18N2O9/c1-8-7-29-17-18(28-2,16(27)20(17)12(8)15(25)26)19-13(22)11(14(23)24)9-3-5-10(21)6-4-9/h3-6,11,17,21H,7H2,1-2H3,(H,19,22)(H,23,24)(H,25,26)