1,2-dihydroacenaphthylen-5-yl-[1-[(1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-yl)carbonyl]piperidin-3-yl]methanone

Systemtic Name: 1,2-dihydroacenaphthylen-5-yl-[1-[(1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-yl)carbonyl]piperidin-3-yl]methanone Openeye Name: 1,2-dihydroacenaphthylen-5-yl-[1-(1-oxido-2,1,3-benzoxadiazol-1-ium-5-carbonyl)-3-piperidyl]methanone CAS Name: 1,2-dihydroacenaphthylen-5-yl-[1-[(1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)-oxomethyl]-3-piperidinyl]methanone IUPAC Name: 1,2-dihydroacenaphthylen-5-yl-[1-(1-oxido-2,1,3-benzoxadiazol-1-ium-5-carbonyl)piperidin-3-yl]methanone Traditional Name: acenaphthen-5-yl-[1-(1-oxidobenzofurazan-1-ium-5-carbonyl)-3-piperidyl]methanone Formula: C25H21N3O4 MolecularWeight: 427.45194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC3=NO[N+](=C3C=C2)[O-])C(=O)C4=C5C=CC=C6C5=C(CC6)C=C4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC3=NO[N+](=C3C=C2)[O-])C(=O)C4=C5C=CC=C6C5=C(CC6)C=C4

InChI

InChI=1S/C25H21N3O4/c29-24(20-10-8-16-7-6-15-3-1-5-19(20)23(15)16)18-4-2-12-27(14-18)25(30)17-9-11-22-21(13-17)26-32-28(22)31/h1,3,5,8-11,13,18H,2,4,6-7,12,14H2