6-[2-[(4-hydroxyphenyl)-methyl-amino]-1-oxidanyl-2-oxidanylidene-ethyl]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 6-[2-[(4-hydroxyphenyl)-methyl-amino]-1-oxidanyl-2-oxidanylidene-ethyl]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-[1-hydroxy-2-(4-hydroxy-N-methyl-anilino)-2-oxo-ethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-[1-hydroxy-2-(4-hydroxy-N-methylanilino)-2-oxoethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-[1-hydroxy-2-(4-hydroxy-N-methylanilino)-2-oxoethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-[1-hydroxy-2-(4-hydroxy-N-methyl-anilino)-2-keto-ethyl]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C17H20N2O6S MolecularWeight: 380.4155

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)C(C(=O)N(C)C3=CC=C(C=C3)O)O)C(=O)O)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)C(C(=O)N(C)C3=CC=C(C=C3)O)O)C(=O)O)C

InChI

InChI=1S/C17H20N2O6S/c1-17(2)12(16(24)25)19-13(22)10(15(19)26-17)11(21)14(23)18(3)8-4-6-9(20)7-5-8/h4-7,10-12,15,20-21H,1-3H3,(H,24,25)