7-azanyl-3-[(5-chloranylthiophen-2-yl)methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-azanyl-3-[(5-chloranylthiophen-2-yl)methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-amino-3-[(5-chloro-2-thienyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-amino-3-[(5-chloro-2-thiophenyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-amino-3-[(5-chlorothiophen-2-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-amino-3-[(5-chloro-2-thienyl)methyl]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C12H11ClN2O3S2 MolecularWeight: 330.81034

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)CC3=CC=C(S3)Cl

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)CC3=CC=C(S3)Cl

InChI

InChI=1S/C12H11ClN2O3S2/c13-7-2-1-6(20-7)3-5-4-19-11-8(14)10(16)15(11)9(5)12(17)18/h1-2,8,11H,3-4,14H2,(H,17,18)