4-azanyl-5-chloranyl-N-(1,4-diazabicyclo[2.2.2]octan-3-ylmethyl)-2-methoxy-benzamide

Systemtic Name: 4-azanyl-5-chloranyl-N-(1,4-diazabicyclo[2.2.2]octan-3-ylmethyl)-2-methoxy-benzamide Openeye Name: 4-amino-5-chloro-N-(1,4-diazabicyclo[2.2.2]octan-3-ylmethyl)-2-methoxy-benzamide CAS Name: 4-amino-5-chloro-N-(1,4-diazabicyclo[2.2.2]octan-3-ylmethyl)-2-methoxybenzamide IUPAC Name: 4-amino-5-chloro-N-(1,4-diazabicyclo[2.2.2]octan-3-ylmethyl)-2-methoxybenzamide Traditional Name: 4-amino-5-chloro-N-(1,4-diazabicyclo[2.2.2]octan-3-ylmethyl)-2-methoxy-benzamide Formula: C15H21ClN4O2 MolecularWeight: 324.80584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NCC2CN3CCN2CC3)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NCC2CN3CCN2CC3)Cl)N

InChI

InChI=1S/C15H21ClN4O2/c1-22-14-7-13(17)12(16)6-11(14)15(21)18-8-10-9-19-2-4-20(10)5-3-19/h6-7,10H,2-5,8-9,17H2,1H3,(H,18,21)