2-[[2-aminocarbonyl-4-methyl-3-(2-piperidin-4-ylethyl)phenyl]carbonylamino]propanoic acid

Systemtic Name: 2-[[2-aminocarbonyl-4-methyl-3-(2-piperidin-4-ylethyl)phenyl]carbonylamino]propanoic acid Openeye Name: 2-[[2-carbamoyl-4-methyl-3-[2-(4-piperidyl)ethyl]benzoyl]amino]propanoic acid CAS Name: 2-[[[2-carbamoyl-4-methyl-3-[2-(4-piperidinyl)ethyl]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 2-[[2-carbamoyl-4-methyl-3-(2-piperidin-4-ylethyl)benzoyl]amino]propanoic acid Traditional Name: 2-[[2-carbamoyl-4-methyl-3-[2-(4-piperidyl)ethyl]benzoyl]amino]propionic acid Formula: C19H27N3O4 MolecularWeight: 361.43538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)NC(C)C(=O)O)C(=O)N)CCC2CCNCC2

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)NC(C)C(=O)O)C(=O)N)CCC2CCNCC2

InChI

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