2-[[4-methyl-2-(2-piperidin-4-ylethylcarbamoyl)phenyl]carbonylamino]propanoic acid

Systemtic Name: 2-[[4-methyl-2-(2-piperidin-4-ylethylcarbamoyl)phenyl]carbonylamino]propanoic acid Openeye Name: 2-[[4-methyl-2-[2-(4-piperidyl)ethylcarbamoyl]benzoyl]amino]propanoic acid CAS Name: 2-[[[4-methyl-2-[oxo-[2-(4-piperidinyl)ethylamino]methyl]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 2-[[4-methyl-2-(2-piperidin-4-ylethylcarbamoyl)benzoyl]amino]propanoic acid Traditional Name: 2-[[4-methyl-2-[2-(4-piperidyl)ethylcarbamoyl]benzoyl]amino]propionic acid Formula: C19H27N3O4 MolecularWeight: 361.43538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC(C)C(=O)O)C(=O)NCCC2CCNCC2

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC(C)C(=O)O)C(=O)NCCC2CCNCC2

InChI

InChI=1S/C19H27N3O4/c1-12-3-4-15(18(24)22-13(2)19(25)26)16(11-12)17(23)21-10-7-14-5-8-20-9-6-14/h3-4,11,13-14,20H,5-10H2,1-2H3,(H,21,23)(H,22,24)(H,25,26)