sodium (2S,5R,6R)-6-[[2-(2-methoxyphenoxy)-4-methyl-2-propan-2-yl-pentanoyl]amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: sodium (2S,5R,6R)-6-[[2-(2-methoxyphenoxy)-4-methyl-2-propan-2-yl-pentanoyl]amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: sodium (2S,5R,6R)-6-[[2-isopropyl-2-(2-methoxyphenoxy)-4-methyl-pentanoyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: sodium (2S,5R,6R)-6-[[2-(2-methoxyphenoxy)-4-methyl-1-oxo-2-propan-2-ylpentyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate IUPAC Name: sodium (2S,5R,6R)-6-[[2-(2-methoxyphenoxy)-4-methyl-2-propan-2-ylpentanoyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: sodium (2S,5R,6R)-6-[[2-isopropyl-2-(2-methoxyphenoxy)-4-methyl-pentanoyl]amino]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Formula: C24H33N2NaO6S MolecularWeight: 500.58339

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C)C)(C(=O)NC1C2N(C1=O)C(C(S2)(C)C)C(=O)[O-])OC3=CC=CC=C3OC.[Na+]

Isomeric SMILES

CC(C)CC(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.[Na+]

InChI

InChI=1S/C24H34N2O6S.Na/c1-13(2)12-24(14(3)4,32-16-11-9-8-10-15(16)31-7)22(30)25-17-19(27)26-18(21(28)29)23(5,6)33-20(17)26;/h8-11,13-14,17-18,20H,12H2,1-7H3,(H,25,30)(H,28,29);/q;+1/p-1/t17-,18+,20-,24?;/m1./s1