3-[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one

Systemtic Name: 3-[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one Openeye Name: 3-[2-[(3R,5R)-3,5-dimethyl-1-piperidyl]-2-oxo-ethyl]quinazolin-4-one CAS Name: 3-[2-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-2-oxoethyl]-4-quinazolinone IUPAC Name: 3-[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl]quinazolin-4-one Traditional Name: 3-[2-[(3R,5R)-3,5-dimethylpiperidino]-2-keto-ethyl]quinazolin-4-one Formula: C17H21N3O2 MolecularWeight: 299.36754

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CN2C=NC3=CC=CC=C3C2=O)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)C(=O)CN2C=NC3=CC=CC=C3C2=O)C

InChI

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