1-[2-[4-[2-oxidanylidene-3-(4-phenoxyphenyl)imidazol-1-yl]phenoxy]ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-[4-[2-oxidanylidene-3-(4-phenoxyphenyl)imidazol-1-yl]phenoxy]ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-[4-[2-oxo-3-(4-phenoxyphenyl)imidazol-1-yl]phenoxy]ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-[4-[2-oxo-3-(4-phenoxyphenyl)-1-imidazolyl]phenoxy]ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-[4-[2-oxo-3-(4-phenoxyphenyl)imidazol-1-yl]phenoxy]ethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-[4-[2-keto-3-(4-phenoxyphenyl)-4-imidazolin-1-yl]phenoxy]ethyl]nipecotic acid Formula: C29H29N3O5 MolecularWeight: 499.55766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCOC2=CC=C(C=C2)N3C=CN(C3=O)C4=CC=C(C=C4)OC5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CCOC2=CC=C(C=C2)N3C=CN(C3=O)C4=CC=C(C=C4)OC5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C29H29N3O5/c33-28(34)22-5-4-16-30(21-22)19-20-36-25-12-8-23(9-13-25)31-17-18-32(29(31)35)24-10-14-27(15-11-24)37-26-6-2-1-3-7-26/h1-3,6-15,17-18,22H,4-5,16,19-21H2,(H,33,34)