[2-(cyclohexylamino)pyridin-1-ium-1-yl]-(3-methyl-2-nitro-phenyl)methanone

Systemtic Name: [2-(cyclohexylamino)pyridin-1-ium-1-yl]-(3-methyl-2-nitro-phenyl)methanone Openeye Name: [2-(cyclohexylamino)pyridin-1-ium-1-yl]-(3-methyl-2-nitro-phenyl)methanone CAS Name: [2-(cyclohexylamino)-1-pyridin-1-iumyl]-(3-methyl-2-nitrophenyl)methanone IUPAC Name: [2-(cyclohexylamino)pyridin-1-ium-1-yl]-(3-methyl-2-nitrophenyl)methanone Traditional Name: [2-(cyclohexylamino)pyridin-1-ium-1-yl]-(3-methyl-2-nitro-phenyl)methanone Formula: C19H22N3O3+ MolecularWeight: 340.39628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)[N+]2=CC=CC=C2NC3CCCCC3

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)[N+]2=CC=CC=C2NC3CCCCC3

InChI

InChI=1S/C19H21N3O3/c1-14-8-7-11-16(18(14)22(24)25)19(23)21-13-6-5-12-17(21)20-15-9-3-2-4-10-15/h5-8,11-13,15H,2-4,9-10H2,1H3/p+1