2,6-dimethyl-4-[3-[3-(4-phenylpiperidin-1-yl)propanoylamino]phenyl]piperidine-3,5-dicarboxylic acid

Systemtic Name: 2,6-dimethyl-4-[3-[3-(4-phenylpiperidin-1-yl)propanoylamino]phenyl]piperidine-3,5-dicarboxylic acid Openeye Name: 2,6-dimethyl-4-[3-[3-(4-phenyl-1-piperidyl)propanoylamino]phenyl]piperidine-3,5-dicarboxylic acid CAS Name: 2,6-dimethyl-4-[3-[[1-oxo-3-(4-phenyl-1-piperidinyl)propyl]amino]phenyl]piperidine-3,5-dicarboxylic acid IUPAC Name: 2,6-dimethyl-4-[3-[3-(4-phenylpiperidin-1-yl)propanoylamino]phenyl]piperidine-3,5-dicarboxylic acid Traditional Name: 2,6-dimethyl-4-[3-[3-(4-phenylpiperidino)propanoylamino]phenyl]piperidine-3,5-dicarboxylic acid Formula: C29H37N3O5 MolecularWeight: 507.62118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(N1)C)C(=O)O)C2=CC(=CC=C2)NC(=O)CCN3CCC(CC3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1C(C(C(C(N1)C)C(=O)O)C2=CC(=CC=C2)NC(=O)CCN3CCC(CC3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C29H37N3O5/c1-18-25(28(34)35)27(26(29(36)37)19(2)30-18)22-9-6-10-23(17-22)31-24(33)13-16-32-14-11-21(12-15-32)20-7-4-3-5-8-20/h3-10,17-19,21,25-27,30H,11-16H2,1-2H3,(H,31,33)(H,34,35)(H,36,37)