3-[4-[(3-methylphenyl)carbamoyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[(3-methylphenyl)carbamoyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-(m-tolylcarbamoyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-[(3-methylanilino)-oxomethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[(3-methylphenyl)carbamoyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(m-tolylcarbamoyl)piperazino]propionic acid Formula: C15H21N3O3 MolecularWeight: 291.34554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCN(CC2)CCC(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCN(CC2)CCC(=O)O

InChI

InChI=1S/C15H21N3O3/c1-12-3-2-4-13(11-12)16-15(21)18-9-7-17(8-10-18)6-5-14(19)20/h2-4,11H,5-10H2,1H3,(H,16,21)(H,19,20)