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

Systemtic Name: 7-chloranyl-3-[2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one Openeye Name: 7-chloro-3-[2-[(2S,6S)-2,6-dimethyl-1-piperidyl]-2-oxo-ethyl]quinazolin-4-one CAS Name: 7-chloro-3-[2-[(2S,6S)-2,6-dimethyl-1-piperidinyl]-2-oxoethyl]-4-quinazolinone IUPAC Name: 7-chloro-3-[2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl]quinazolin-4-one Traditional Name: 7-chloro-3-[2-[(2S,6S)-2,6-dimethylpiperidino]-2-keto-ethyl]quinazolin-4-one Formula: C17H20ClN3O2 MolecularWeight: 333.8126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20ClN3O2/c1-11-4-3-5-12(2)21(11)16(22)9-20-10-19-15-8-13(18)6-7-14(15)17(20)23/h6-8,10-12H,3-5,9H2,1-2H3/t11-,12-/m0/s1