1-(2-chloranylquinazolin-4-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(2-chloranylquinazolin-4-yl)piperidine-4-carboxylic acid Openeye Name: 1-(2-chloroquinazolin-4-yl)piperidine-4-carboxylic acid CAS Name: 1-(2-chloro-4-quinazolinyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(2-chloroquinazolin-4-yl)piperidine-4-carboxylic acid Traditional Name: 1-(2-chloroquinazolin-4-yl)isonipecotic acid Formula: C14H14ClN3O2 MolecularWeight: 291.73286

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=NC(=NC3=CC=CC=C32)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=NC(=NC3=CC=CC=C32)Cl

InChI

InChI=1S/C14H14ClN3O2/c15-14-16-11-4-2-1-3-10(11)12(17-14)18-7-5-9(6-8-18)13(19)20/h1-4,9H,5-8H2,(H,19,20)