2-oxidanylideneethyl (E)-2-(4-aminocarbonylphenyl)-7-oxidanyl-5-(2-oxidanylidenecyclopentyl)-3-(2-oxidanyl-3-phenoxy-propoxy)hept-4-enoate

Systemtic Name: 2-oxidanylideneethyl (E)-2-(4-aminocarbonylphenyl)-7-oxidanyl-5-(2-oxidanylidenecyclopentyl)-3-(2-oxidanyl-3-phenoxy-propoxy)hept-4-enoate Openeye Name: 2-oxoethyl (E)-2-(4-carbamoylphenyl)-7-hydroxy-3-(2-hydroxy-3-phenoxy-propoxy)-5-(2-oxocyclopentyl)hept-4-enoate CAS Name: (E)-2-(4-carbamoylphenyl)-7-hydroxy-3-(2-hydroxy-3-phenoxypropoxy)-5-(2-oxocyclopentyl)-4-heptenoic acid 2-oxoethyl ester IUPAC Name: 2-oxoethyl (E)-2-(4-carbamoylphenyl)-7-hydroxy-3-(2-hydroxy-3-phenoxypropoxy)-5-(2-oxocyclopentyl)hept-4-enoate Traditional Name: (E)-2-(4-carbamoylphenyl)-7-hydroxy-3-(2-hydroxy-3-phenoxy-propoxy)-5-(2-ketocyclopentyl)hept-4-enoic acid 2-ketoethyl ester Formula: C30H35NO9 MolecularWeight: 553.6002

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)C1)C(=CC(C(C2=CC=C(C=C2)C(=O)N)C(=O)OCC=O)OCC(COC3=CC=CC=C3)O)CCO

Isomeric SMILES

C1CC(C(=O)C1)/C(=C/C(C(C2=CC=C(C=C2)C(=O)N)C(=O)OCC=O)OCC(COC3=CC=CC=C3)O)/CCO

InChI

InChI=1S/C30H35NO9/c31-29(36)21-11-9-20(10-12-21)28(30(37)38-16-15-33)27(17-22(13-14-32)25-7-4-8-26(25)35)40-19-23(34)18-39-24-5-2-1-3-6-24/h1-3,5-6,9-12,15,17,23,25,27-28,32,34H,4,7-8,13-14,16,18-19H2,(H2,31,36)/b22-17+