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

Systemtic Name: 3-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one Openeye Name: 3-[2-[(2R,6R)-2,6-dimethyl-1-piperidyl]-2-oxo-ethyl]quinazolin-4-one CAS Name: 3-[2-[(2R,6R)-2,6-dimethyl-1-piperidinyl]-2-oxoethyl]-4-quinazolinone IUPAC Name: 3-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl]quinazolin-4-one Traditional Name: 3-[2-[(2R,6R)-2,6-dimethylpiperidino]-2-keto-ethyl]quinazolin-4-one Formula: C17H21N3O2 MolecularWeight: 299.36754

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CN2C=NC3=CC=CC=C3C2=O)C

Isomeric SMILES

C[C@@H]1CCC[C@H](N1C(=O)CN2C=NC3=CC=CC=C3C2=O)C

InChI

InChI=1S/C17H21N3O2/c1-12-6-5-7-13(2)20(12)16(21)10-19-11-18-15-9-4-3-8-14(15)17(19)22/h3-4,8-9,11-13H,5-7,10H2,1-2H3/t12-,13-/m1/s1