3-(1-azanylpentyl)-6-(1-hydroxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 3-(1-azanylpentyl)-6-(1-hydroxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 3-(1-aminopentyl)-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 3-(1-aminopentyl)-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 3-(1-aminopentyl)-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 3-(1-aminopentyl)-6-(1-hydroxyethyl)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=C(N2C(S1)C(C2=O)C(C)O)C(=O)O)N

Isomeric SMILES

CCCCC(C1=C(N2C(S1)C(C2=O)C(C)O)C(=O)O)N

InChI

InChI=1S/C13H20N2O4S/c1-3-4-5-7(14)10-9(13(18)19)15-11(17)8(6(2)16)12(15)20-10/h6-8,12,16H,3-5,14H2,1-2H3,(H,18,19)