(5S)-3-(3-azanylpropyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: (5S)-3-(3-azanylpropyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: (5S)-3-(3-aminopropyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: (5S)-3-(3-aminopropyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: (5S)-3-(3-aminopropyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: (5S)-3-(3-aminopropyl)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C9H12N2O3S MolecularWeight: 228.26818

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Descriptors Computed from Structure

Canonical SMILES:

C1C2N(C1=O)C(=C(S2)CCCN)C(=O)O

Isomeric SMILES

C1[C@H]2N(C1=O)C(=C(S2)CCCN)C(=O)O

InChI

InChI=1S/C9H12N2O3S/c10-3-1-2-5-8(9(13)14)11-6(12)4-7(11)15-5/h7H,1-4,10H2,(H,13,14)/t7-/m0/s1