N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-2-ethoxy-5-iodanyl-3-methoxy-benzamide

Systemtic Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-2-ethoxy-5-iodanyl-3-methoxy-benzamide Openeye Name: 2-ethoxy-5-iodo-3-methoxy-N-[(3S)-quinuclidin-3-yl]benzamide CAS Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-2-ethoxy-5-iodo-3-methoxybenzamide IUPAC Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-2-ethoxy-5-iodo-3-methoxybenzamide Traditional Name: 2-ethoxy-5-iodo-3-methoxy-N-[(3S)-quinuclidin-3-yl]benzamide Formula: C17H23IN2O3 MolecularWeight: 430.28059

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1C(=O)NC2CN3CCC2CC3)I)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1C(=O)N[C@@H]2CN3CCC2CC3)I)OC

InChI

InChI=1S/C17H23IN2O3/c1-3-23-16-13(8-12(18)9-15(16)22-2)17(21)19-14-10-20-6-4-11(14)5-7-20/h8-9,11,14H,3-7,10H2,1-2H3,(H,19,21)/t14-/m1/s1