2-tert-butyl-4-quinolin-5-yl-piperazine-1-carboxylic acid

Systemtic Name: 2-tert-butyl-4-quinolin-5-yl-piperazine-1-carboxylic acid Openeye Name: 2-tert-butyl-4-(5-quinolyl)piperazine-1-carboxylic acid CAS Name: 2-tert-butyl-4-(5-quinolinyl)-1-piperazinecarboxylic acid IUPAC Name: 2-tert-butyl-4-quinolin-5-ylpiperazine-1-carboxylic acid Traditional Name: 2-tert-butyl-4-(5-quinolyl)piperazine-1-carboxylic acid Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CN(CCN1C(=O)O)C2=CC=CC3=C2C=CC=N3

Isomeric SMILES

CC(C)(C)C1CN(CCN1C(=O)O)C2=CC=CC3=C2C=CC=N3

InChI

InChI=1S/C18H23N3O2/c1-18(2,3)16-12-20(10-11-21(16)17(22)23)15-8-4-7-14-13(15)6-5-9-19-14/h4-9,16H,10-12H2,1-3H3,(H,22,23)