2-[4-oxidanylidene-2-(piperidin-1-ylmethyl)quinazolin-3-yl]ethanoic acid

Systemtic Name: 2-[4-oxidanylidene-2-(piperidin-1-ylmethyl)quinazolin-3-yl]ethanoic acid Openeye Name: 2-[4-oxo-2-(1-piperidylmethyl)quinazolin-3-yl]acetic acid CAS Name: 2-[4-oxo-2-(1-piperidinylmethyl)-3-quinazolinyl]acetic acid IUPAC Name: 2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]acetic acid Traditional Name: 2-[4-keto-2-(piperidinomethyl)quinazolin-3-yl]acetic acid Formula: C16H19N3O3 MolecularWeight: 301.34036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)O

Isomeric SMILES

C1CCN(CC1)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)O

InChI

InChI=1S/C16H19N3O3/c20-15(21)11-19-14(10-18-8-4-1-5-9-18)17-13-7-3-2-6-12(13)16(19)22/h2-3,6-7H,1,4-5,8-11H2,(H,20,21)