1-(4-fluoranyl-2-methyl-phenyl)-4-(phenylmethyl)piperazine-2-carboxylic acid

Systemtic Name: 1-(4-fluoranyl-2-methyl-phenyl)-4-(phenylmethyl)piperazine-2-carboxylic acid Openeye Name: 4-benzyl-1-(4-fluoro-2-methyl-phenyl)piperazine-2-carboxylic acid CAS Name: 1-(4-fluoro-2-methylphenyl)-4-(phenylmethyl)-2-piperazinecarboxylic acid IUPAC Name: 4-benzyl-1-(4-fluoro-2-methylphenyl)piperazine-2-carboxylic acid Traditional Name: 4-benzyl-1-(4-fluoro-2-methyl-phenyl)piperazine-2-carboxylic acid Formula: C19H21FN2O2 MolecularWeight: 328.380643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)N2CCN(CC2C(=O)O)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)F)N2CCN(CC2C(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C19H21FN2O2/c1-14-11-16(20)7-8-17(14)22-10-9-21(13-18(22)19(23)24)12-15-5-3-2-4-6-15/h2-8,11,18H,9-10,12-13H2,1H3,(H,23,24)