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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCC(C1=CC=C(C=C1)C(=O)N)(C(CC=O)(C(=O)OC2CCCC2=O)OCC(COC3=CC=CC=C3)O)O

Isomeric SMILES

C/C=C/CC(C1=CC=C(C=C1)C(=O)N)(C(CC=O)(C(=O)OC2CCCC2=O)OCC(COC3=CC=CC=C3)O)O

InChI

InChI=1S/C30H35NO9/c1-2-3-16-29(37,22-14-12-21(13-15-22)27(31)35)30(17-18-32,28(36)40-26-11-7-10-25(26)34)39-20-23(33)19-38-24-8-5-4-6-9-24/h2-6,8-9,12-15,18,23,26,33,37H,7,10-11,16-17,19-20H2,1H3,(H2,31,35)/b3-2+