2-[4-(2-methylquinolin-4-yl)piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(2-methylquinolin-4-yl)piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(2-methyl-4-quinolyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-(2-methyl-4-quinolinyl)-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(2-methylquinolin-4-yl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(2-methyl-4-quinolyl)piperazino]acetic acid Formula: C16H19N3O2 MolecularWeight: 285.34096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)N3CCN(CC3)CC(=O)O

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)N3CCN(CC3)CC(=O)O

InChI

InChI=1S/C16H19N3O2/c1-12-10-15(13-4-2-3-5-14(13)17-12)19-8-6-18(7-9-19)11-16(20)21/h2-5,10H,6-9,11H2,1H3,(H,20,21)