6-oxidanylidene-6-[(1-phenethylpiperidin-4-yl)-phenyl-amino]hexanoic acid

Systemtic Name: 6-oxidanylidene-6-[(1-phenethylpiperidin-4-yl)-phenyl-amino]hexanoic acid Openeye Name: 6-oxo-6-(N-(1-phenethyl-4-piperidyl)anilino)hexanoic acid CAS Name: 6-oxo-6-(N-(1-phenethyl-4-piperidinyl)anilino)hexanoic acid IUPAC Name: 6-oxo-6-(N-(1-phenethylpiperidin-4-yl)anilino)hexanoic acid Traditional Name: 6-keto-6-(N-(1-phenethyl-4-piperidyl)anilino)hexanoic acid Formula: C25H32N2O3 MolecularWeight: 408.53318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N(C2=CC=CC=C2)C(=O)CCCCC(=O)O)CCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1N(C2=CC=CC=C2)C(=O)CCCCC(=O)O)CCC3=CC=CC=C3

InChI

InChI=1S/C25H32N2O3/c28-24(13-7-8-14-25(29)30)27(22-11-5-2-6-12-22)23-16-19-26(20-17-23)18-15-21-9-3-1-4-10-21/h1-6,9-12,23H,7-8,13-20H2,(H,29,30)