[3-(chloromethyl)-1-oxidanidyl-quinoxalin-1-ium-2-yl]-(1-oxidanidylpiperidin-1-ium-1-yl)methanone

Systemtic Name: [3-(chloromethyl)-1-oxidanidyl-quinoxalin-1-ium-2-yl]-(1-oxidanidylpiperidin-1-ium-1-yl)methanone Openeye Name: [3-(chloromethyl)-1-oxido-quinoxalin-1-ium-2-yl]-(1-oxidopiperidin-1-ium-1-yl)methanone CAS Name: [3-(chloromethyl)-1-oxido-2-quinoxalin-1-iumyl]-(1-oxido-1-piperidin-1-iumyl)methanone IUPAC Name: [3-(chloromethyl)-1-oxidoquinoxalin-1-ium-2-yl]-(1-oxidopiperidin-1-ium-1-yl)methanone Traditional Name: [3-(chloromethyl)-1-oxido-quinoxalin-1-ium-2-yl]-(1-oxidopiperidin-1-ium-1-yl)methanone Formula: C15H16ClN3O3 MolecularWeight: 321.75884

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(C(=O)C2=[N+](C3=CC=CC=C3N=C2CCl)[O-])[O-]

Isomeric SMILES

C1CC[N+](CC1)(C(=O)C2=[N+](C3=CC=CC=C3N=C2CCl)[O-])[O-]

InChI

InChI=1S/C15H16ClN3O3/c16-10-12-14(15(20)19(22)8-4-1-5-9-19)18(21)13-7-3-2-6-11(13)17-12/h2-3,6-7H,1,4-5,8-10H2