3,5-bis(2-morpholin-4-ylethoxymethyl)-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylic acid

Systemtic Name: 3,5-bis(2-morpholin-4-ylethoxymethyl)-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylic acid Openeye Name: 4-[4-(3-benzyloxypropoxy)phenyl]-3,5-bis(2-morpholinoethoxymethyl)piperidine-1-carboxylic acid CAS Name: 3,5-bis[2-(4-morpholinyl)ethoxymethyl]-4-[4-(3-phenylmethoxypropoxy)phenyl]-1-piperidinecarboxylic acid IUPAC Name: 3,5-bis(2-morpholin-4-ylethoxymethyl)-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine-1-carboxylic acid Traditional Name: 4-[4-(3-benzoxypropoxy)phenyl]-3,5-bis(2-morpholinoethoxymethyl)piperidine-1-carboxylic acid Formula: C36H53N3O8 MolecularWeight: 655.82132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCOCC2CN(CC(C2C3=CC=C(C=C3)OCCCOCC4=CC=CC=C4)COCCN5CCOCC5)C(=O)O

Isomeric SMILES

C1COCCN1CCOCC2CN(CC(C2C3=CC=C(C=C3)OCCCOCC4=CC=CC=C4)COCCN5CCOCC5)C(=O)O

InChI

InChI=1S/C36H53N3O8/c40-36(41)39-25-32(28-45-23-15-37-11-19-42-20-12-37)35(33(26-39)29-46-24-16-38-13-21-43-22-14-38)31-7-9-34(10-8-31)47-18-4-17-44-27-30-5-2-1-3-6-30/h1-3,5-10,32-33,35H,4,11-29H2,(H,40,41)