6-chloranyl-3-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one

Systemtic Name: 6-chloranyl-3-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one Openeye Name: 6-chloro-3-[2-[(2R,6R)-2,6-dimethyl-1-piperidyl]-2-oxo-ethyl]quinazolin-4-one CAS Name: 6-chloro-3-[2-[(2R,6R)-2,6-dimethyl-1-piperidinyl]-2-oxoethyl]-4-quinazolinone IUPAC Name: 6-chloro-3-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl]quinazolin-4-one Traditional Name: 6-chloro-3-[2-[(2R,6R)-2,6-dimethylpiperidino]-2-keto-ethyl]quinazolin-4-one Formula: C17H20ClN3O2 MolecularWeight: 333.8126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Cl)C

Isomeric SMILES

C[C@@H]1CCC[C@H](N1C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Cl)C

InChI

InChI=1S/C17H20ClN3O2/c1-11-4-3-5-12(2)21(11)16(22)9-20-10-19-15-7-6-13(18)8-14(15)17(20)23/h6-8,10-12H,3-5,9H2,1-2H3/t11-,12-/m1/s1