3-[[2,6-diethyl-2,3,6-trimethyl-1-(1-phenylethoxy)piperidin-4-yl]carbamoyl]benzoic acid

Systemtic Name: 3-[[2,6-diethyl-2,3,6-trimethyl-1-(1-phenylethoxy)piperidin-4-yl]carbamoyl]benzoic acid Openeye Name: 3-[[2,6-diethyl-2,3,6-trimethyl-1-(1-phenylethoxy)-4-piperidyl]carbamoyl]benzoic acid CAS Name: 3-[[[2,6-diethyl-2,3,6-trimethyl-1-(1-phenylethoxy)-4-piperidinyl]amino]-oxomethyl]benzoic acid IUPAC Name: 3-[[2,6-diethyl-2,3,6-trimethyl-1-(1-phenylethoxy)piperidin-4-yl]carbamoyl]benzoic acid Traditional Name: 3-[[2,6-diethyl-2,3,6-trimethyl-1-(1-phenylethoxy)-4-piperidyl]carbamoyl]benzoic acid Formula: C28H38N2O4 MolecularWeight: 466.61232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(C(C(N1OC(C)C2=CC=CC=C2)(C)CC)C)NC(=O)C3=CC(=CC=C3)C(=O)O)C

Isomeric SMILES

CCC1(CC(C(C(N1OC(C)C2=CC=CC=C2)(C)CC)C)NC(=O)C3=CC(=CC=C3)C(=O)O)C

InChI

InChI=1S/C28H38N2O4/c1-7-27(5)18-24(29-25(31)22-15-12-16-23(17-22)26(32)33)19(3)28(6,8-2)30(27)34-20(4)21-13-10-9-11-14-21/h9-17,19-20,24H,7-8,18H2,1-6H3,(H,29,31)(H,32,33)