3-[2-(5-chloranyl-2-phenylmethoxy-phenyl)cyclopenten-1-yl]-5-(2-oxidanylidenepyrrolidin-1-yl)benzoic acid

Systemtic Name: 3-[2-(5-chloranyl-2-phenylmethoxy-phenyl)cyclopenten-1-yl]-5-(2-oxidanylidenepyrrolidin-1-yl)benzoic acid Openeye Name: 3-[2-(2-benzyloxy-5-chloro-phenyl)cyclopenten-1-yl]-5-(2-oxopyrrolidin-1-yl)benzoic acid CAS Name: 3-[2-(5-chloro-2-phenylmethoxyphenyl)-1-cyclopentenyl]-5-(2-oxo-1-pyrrolidinyl)benzoic acid IUPAC Name: 3-[2-(5-chloro-2-phenylmethoxyphenyl)cyclopenten-1-yl]-5-(2-oxopyrrolidin-1-yl)benzoic acid Traditional Name: 3-[2-(2-benzoxy-5-chloro-phenyl)cyclopenten-1-yl]-5-(2-ketopyrrolidino)benzoic acid Formula: C29H26ClNO4 MolecularWeight: 487.97404

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C1)C2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3)C4=CC(=CC(=C4)N5CCCC5=O)C(=O)O

Isomeric SMILES

C1CC(=C(C1)C2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3)C4=CC(=CC(=C4)N5CCCC5=O)C(=O)O

InChI

InChI=1S/C29H26ClNO4/c30-22-11-12-27(35-18-19-6-2-1-3-7-19)26(17-22)25-9-4-8-24(25)20-14-21(29(33)34)16-23(15-20)31-13-5-10-28(31)32/h1-3,6-7,11-12,14-17H,4-5,8-10,13,18H2,(H,33,34)