[2-acetyloxy-4-[(E)-2-[7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-2-carboxyoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]ethenyl]phenyl] ethanoate

Systemtic Name: [2-acetyloxy-4-[(E)-2-[7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-2-carboxyoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]ethenyl]phenyl] ethanoate Openeye Name: [2-acetoxy-4-[(E)-2-[7-[[(2E)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-2-carboxyoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]vinyl]phenyl] acetate CAS Name: acetic acid [2-acetyloxy-4-[(E)-2-[7-[[(2E)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-2-carboxyoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]ethenyl]phenyl] ester IUPAC Name: [2-acetyloxy-4-[(E)-2-[7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-2-carboxyoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]ethenyl]phenyl] acetate Traditional Name: acetic acid [2-acetoxy-4-[(E)-2-[7-[[(2E)-2-(2-aminothiazol-4-yl)-2-methyloximino-acetyl]amino]-2-carboxyoxy-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]vinyl]phenyl] ester Formula: C25H23N5O10S2 MolecularWeight: 617.60762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C=CC2=C(N3C(C(C3=O)NC(=O)C(=NOC)C4=CSC(=N4)N)SC2)OC(=O)O)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)/C=C/C2=C(N3C(C(C3=O)NC(=O)/C(=N/OC)/C4=CSC(=N4)N)SC2)OC(=O)O)OC(=O)C

InChI

InChI=1S/C25H23N5O10S2/c1-11(31)38-16-7-5-13(8-17(16)39-12(2)32)4-6-14-9-41-23-19(21(34)30(23)22(14)40-25(35)36)28-20(33)18(29-37-3)15-10-42-24(26)27-15/h4-8,10,19,23H,9H2,1-3H3,(H2,26,27)(H,28,33)(H,35,36)/b6-4+,29-18+