7-[2-(2-aminophenyl)ethanoylamino]-8-oxidanylidene-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-[2-(2-aminophenyl)ethanoylamino]-8-oxidanylidene-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-[[2-(2-aminophenyl)acetyl]amino]-8-oxo-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-[[2-(2-aminophenyl)-1-oxoethyl]amino]-8-oxo-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-[[2-(2-aminophenyl)acetyl]amino]-8-oxo-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-[[2-(2-aminophenyl)acetyl]amino]-8-keto-4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C15H15N3O4S MolecularWeight: 333.3623

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(C(=O)N2C(=CS1)C(=O)O)NC(=O)CC3=CC=CC=C3N

Isomeric SMILES

C1C2C(C(=O)N2C(=CS1)C(=O)O)NC(=O)CC3=CC=CC=C3N

InChI

InChI=1S/C15H15N3O4S/c16-9-4-2-1-3-8(9)5-12(19)17-13-10-6-23-7-11(15(21)22)18(10)14(13)20/h1-4,7,10,13H,5-6,16H2,(H,17,19)(H,21,22)