N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-N-methyl-1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-carboxamide

Systemtic Name: N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-N-methyl-1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-carboxamide Openeye Name: N-[[1-[2-(2-methoxyphenyl)ethyl]-3-piperidyl]methyl]-N-methyl-1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxamide CAS Name: N-[[1-[2-(2-methoxyphenyl)ethyl]-3-piperidinyl]methyl]-N-methyl-1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxamide IUPAC Name: N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-N-methyl-1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxamide Traditional Name: N-[[1-[2-(2-methoxyphenyl)ethyl]-3-piperidyl]methyl]-N-methyl-1-oxido-benzofurazan-1-ium-5-carboxamide Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCCN(C1)CCC2=CC=CC=C2OC)C(=O)C3=CC4=NO[N+](=C4C=C3)[O-]

Isomeric SMILES

CN(CC1CCCN(C1)CCC2=CC=CC=C2OC)C(=O)C3=CC4=NO[N+](=C4C=C3)[O-]

InChI

InChI=1S/C23H28N4O4/c1-25(23(28)19-9-10-21-20(14-19)24-31-27(21)29)15-17-6-5-12-26(16-17)13-11-18-7-3-4-8-22(18)30-2/h3-4,7-10,14,17H,5-6,11-13,15-16H2,1-2H3