2-[2-oxidanylidene-1-(3-phenylpropyl)-5-[(4-piperidin-4-ylphenoxy)methyl]pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[2-oxidanylidene-1-(3-phenylpropyl)-5-[(4-piperidin-4-ylphenoxy)methyl]pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[2-oxo-1-(3-phenylpropyl)-5-[[4-(4-piperidyl)phenoxy]methyl]pyrrolidin-3-yl]acetic acid CAS Name: 2-[2-oxo-1-(3-phenylpropyl)-5-[[4-(4-piperidinyl)phenoxy]methyl]-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[2-oxo-1-(3-phenylpropyl)-5-[(4-piperidin-4-ylphenoxy)methyl]pyrrolidin-3-yl]acetic acid Traditional Name: 2-[2-keto-1-(3-phenylpropyl)-5-[[4-(4-piperidyl)phenoxy]methyl]pyrrolidin-3-yl]acetic acid Formula: C27H34N2O4 MolecularWeight: 450.56986

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=CC=C(C=C2)OCC3CC(C(=O)N3CCCC4=CC=CC=C4)CC(=O)O

Isomeric SMILES

C1CNCCC1C2=CC=C(C=C2)OCC3CC(C(=O)N3CCCC4=CC=CC=C4)CC(=O)O

InChI

InChI=1S/C27H34N2O4/c30-26(31)18-23-17-24(29(27(23)32)16-4-7-20-5-2-1-3-6-20)19-33-25-10-8-21(9-11-25)22-12-14-28-15-13-22/h1-3,5-6,8-11,22-24,28H,4,7,12-19H2,(H,30,31)