2-[3-[2-(5-azanylpentoxy)phenyl]-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[3-[2-(5-azanylpentoxy)phenyl]-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[3-[2-(5-aminopentoxy)phenyl]-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid CAS Name: 2-[3-[2-(5-aminopentoxy)phenyl]-2-oxo-1-(3-phenylpropyl)-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[3-[2-(5-aminopentoxy)phenyl]-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Traditional Name: 2-[3-[2-(5-aminopentoxy)phenyl]-2-keto-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Formula: C26H34N2O4 MolecularWeight: 438.55916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1(CC(=O)O)C2=CC=CC=C2OCCCCCN)CCCC3=CC=CC=C3

Isomeric SMILES

C1CN(C(=O)C1(CC(=O)O)C2=CC=CC=C2OCCCCCN)CCCC3=CC=CC=C3

InChI

InChI=1S/C26H34N2O4/c27-16-7-2-8-19-32-23-14-6-5-13-22(23)26(20-24(29)30)15-18-28(25(26)31)17-9-12-21-10-3-1-4-11-21/h1,3-6,10-11,13-14H,2,7-9,12,15-20,27H2,(H,29,30)