7-[2-(4-methoxyphenyl)ethanoylamino]-3-methylidene-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid

Systemtic Name: 7-[2-(4-methoxyphenyl)ethanoylamino]-3-methylidene-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Openeye Name: 7-[[2-(4-methoxyphenyl)acetyl]amino]-3-methylene-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid CAS Name: 7-[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-3-methylene-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid IUPAC Name: 7-[[2-(4-methoxyphenyl)acetyl]amino]-3-methylidene-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Traditional Name: 8-keto-7-[[2-(4-methoxyphenyl)acetyl]amino]-3-methylene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC2C3N(C2=O)C(C(=C)CS3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC2C3N(C2=O)C(C(=C)CS3)C(=O)O

InChI

InChI=1S/C17H18N2O5S/c1-9-8-25-16-13(15(21)19(16)14(9)17(22)23)18-12(20)7-10-3-5-11(24-2)6-4-10/h3-6,13-14,16H,1,7-8H2,2H3,(H,18,20)(H,22,23)