(2S,5R,6R)-6-[[2-(2-methoxyphenoxy)-2,4-dimethyl-pentanoyl]amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: (2S,5R,6R)-6-[[2-(2-methoxyphenoxy)-2,4-dimethyl-pentanoyl]amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: (2S,5R,6R)-6-[[2-(2-methoxyphenoxy)-2,4-dimethyl-pentanoyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: (2S,5R,6R)-6-[[2-(2-methoxyphenoxy)-2,4-dimethyl-1-oxopentyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: (2S,5R,6R)-6-[[2-(2-methoxyphenoxy)-2,4-dimethylpentanoyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: (2S,5R,6R)-7-keto-6-[[2-(2-methoxyphenoxy)-2,4-dimethyl-pentanoyl]amino]-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C22H30N2O6S MolecularWeight: 450.5484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)(C(=O)NC1C2N(C1=O)C(C(S2)(C)C)C(=O)O)OC3=CC=CC=C3OC

Isomeric SMILES

CC(C)CC(C)(C(=O)N[C@H]1[C@@H]2N(C1=O)[C@H](C(S2)(C)C)C(=O)O)OC3=CC=CC=C3OC

InChI

InChI=1S/C22H30N2O6S/c1-12(2)11-22(5,30-14-10-8-7-9-13(14)29-6)20(28)23-15-17(25)24-16(19(26)27)21(3,4)31-18(15)24/h7-10,12,15-16,18H,11H2,1-6H3,(H,23,28)(H,26,27)/t15-,16+,18-,22?/m1/s1