4-[4-[3-(6-azanyl-5-chloranyl-2-methoxy-pyridin-3-yl)-3-oxidanylidene-propyl]piperidin-1-yl]-2,2-dimethyl-pentan-3-one

Systemtic Name: 4-[4-[3-(6-azanyl-5-chloranyl-2-methoxy-pyridin-3-yl)-3-oxidanylidene-propyl]piperidin-1-yl]-2,2-dimethyl-pentan-3-one Openeye Name: 4-[4-[3-(6-amino-5-chloro-2-methoxy-3-pyridyl)-3-oxo-propyl]-1-piperidyl]-2,2-dimethyl-pentan-3-one CAS Name: 4-[4-[3-(6-amino-5-chloro-2-methoxy-3-pyridinyl)-3-oxopropyl]-1-piperidinyl]-2,2-dimethyl-3-pentanone IUPAC Name: 4-[4-[3-(6-amino-5-chloro-2-methoxypyridin-3-yl)-3-oxopropyl]piperidin-1-yl]-2,2-dimethylpentan-3-one Traditional Name: 4-[4-[3-(6-amino-5-chloro-2-methoxy-3-pyridyl)-3-keto-propyl]piperidino]-2,2-dimethyl-pentan-3-one Formula: C21H32ClN3O3 MolecularWeight: 409.95008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(C)(C)C)N1CCC(CC1)CCC(=O)C2=CC(=C(N=C2OC)N)Cl

Isomeric SMILES

CC(C(=O)C(C)(C)C)N1CCC(CC1)CCC(=O)C2=CC(=C(N=C2OC)N)Cl

InChI

InChI=1S/C21H32ClN3O3/c1-13(18(27)21(2,3)4)25-10-8-14(9-11-25)6-7-17(26)15-12-16(22)19(23)24-20(15)28-5/h12-14H,6-11H2,1-5H3,(H2,23,24)