1-[4-[(1-ethylpiperidin-1-ium-4-yl)amino]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[(1-ethylpiperidin-1-ium-4-yl)amino]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-[(1-ethylpiperidin-1-ium-4-yl)amino]-3-nitro-phenyl]ethanone CAS Name: 1-[4-[(1-ethyl-4-piperidin-1-iumyl)amino]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[(1-ethylpiperidin-1-ium-4-yl)amino]-3-nitrophenyl]ethanone Traditional Name: 1-[4-[(1-ethylpiperidin-1-ium-4-yl)amino]-3-nitro-phenyl]ethanone Formula: C15H22N3O3+ MolecularWeight: 292.35348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC2=C(C=C(C=C2)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCC(CC1)NC2=C(C=C(C=C2)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O3/c1-3-17-8-6-13(7-9-17)16-14-5-4-12(11(2)19)10-15(14)18(20)21/h4-5,10,13,16H,3,6-9H2,1-2H3/p+1