[4-[(1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-yl)-oxidanyl-methyl]piperidin-1-yl]-phenyl-methanone

Systemtic Name: [4-[(1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-yl)-oxidanyl-methyl]piperidin-1-yl]-phenyl-methanone Openeye Name: [4-[hydroxy-(1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)methyl]-1-piperidyl]-phenyl-methanone CAS Name: [4-[hydroxy-(1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)methyl]-1-piperidinyl]-phenylmethanone IUPAC Name: [4-[hydroxy-(1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)methyl]piperidin-1-yl]-phenylmethanone Traditional Name: [4-[hydroxy-(1-oxidobenzofurazan-1-ium-5-yl)methyl]piperidino]-phenyl-methanone Formula: C19H19N3O4 MolecularWeight: 353.37186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(C2=CC3=NO[N+](=C3C=C2)[O-])O)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(C2=CC3=NO[N+](=C3C=C2)[O-])O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H19N3O4/c23-18(15-6-7-17-16(12-15)20-26-22(17)25)13-8-10-21(11-9-13)19(24)14-4-2-1-3-5-14/h1-7,12-13,18,23H,8-11H2