(Z)-3-chloranyl-7-oxidanylidene-7-phenylmethoxy-2-[2-(phenylmethoxycarbonylamino)-1,3-thiazol-4-yl]hept-2-enoic acid

Systemtic Name: (Z)-3-chloranyl-7-oxidanylidene-7-phenylmethoxy-2-[2-(phenylmethoxycarbonylamino)-1,3-thiazol-4-yl]hept-2-enoic acid Openeye Name: (Z)-7-benzyloxy-2-[2-(benzyloxycarbonylamino)thiazol-4-yl]-3-chloro-7-oxo-hept-2-enoic acid CAS Name: (Z)-3-chloro-7-oxo-7-phenylmethoxy-2-[2-(phenylmethoxycarbonylamino)-4-thiazolyl]-2-heptenoic acid IUPAC Name: (Z)-3-chloro-7-oxo-7-phenylmethoxy-2-[2-(phenylmethoxycarbonylamino)-1,3-thiazol-4-yl]hept-2-enoic acid Traditional Name: (Z)-7-benzoxy-2-[2-(benzyloxycarbonylamino)thiazol-4-yl]-3-chloro-7-keto-hept-2-enoic acid Formula: C25H23ClN2O6S MolecularWeight: 514.97792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCCC(=C(C2=CSC(=N2)NC(=O)OCC3=CC=CC=C3)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCC/C(=C(\C2=CSC(=N2)NC(=O)OCC3=CC=CC=C3)/C(=O)O)/Cl

InChI

InChI=1S/C25H23ClN2O6S/c26-19(12-7-13-21(29)33-14-17-8-3-1-4-9-17)22(23(30)31)20-16-35-24(27-20)28-25(32)34-15-18-10-5-2-6-11-18/h1-6,8-11,16H,7,12-15H2,(H,30,31)(H,27,28,32)/b22-19-