(2S,5R,6R)-6-[[2-(2-methoxyphenoxy)-2-propan-2-yl-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-propan-2-yl-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-isopropyl-2-(2-methoxyphenoxy)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)-1-oxo-2-propan-2-ylpentyl]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-propan-2-ylpentanoyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: (2S,5R,6R)-6-[[2-isopropyl-2-(2-methoxyphenoxy)pentanoyl]amino]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C23H32N2O6S MolecularWeight: 464.57498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCC(C(C)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/C23H32N2O6S/c1-7-12-23(13(2)3,31-15-11-9-8-10-14(15)30-6)21(29)24-16-18(26)25-17(20(27)28)22(4,5)32-19(16)25/h8-11,13,16-17,19H,7,12H2,1-6H3,(H,24,29)(H,27,28)/t16-,17+,19-,23?/m1/s1