[(2R)-1-[(2-cyano-4-nitro-phenyl)amino]-4-methyl-pentan-2-yl]-dimethyl-azanium

Systemtic Name: [(2R)-1-[(2-cyano-4-nitro-phenyl)amino]-4-methyl-pentan-2-yl]-dimethyl-azanium Openeye Name: [(1R)-1-[(2-cyano-4-nitro-anilino)methyl]-3-methyl-butyl]-dimethyl-ammonium CAS Name: [(2R)-1-(2-cyano-4-nitroanilino)-4-methylpentan-2-yl]-dimethylammonium IUPAC Name: [(2R)-1-(2-cyano-4-nitroanilino)-4-methylpentan-2-yl]-dimethylazanium Traditional Name: [(1R)-1-[(2-cyano-4-nitro-anilino)methyl]-3-methyl-butyl]-dimethyl-ammonium Formula: C15H23N4O2+ MolecularWeight: 291.36872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC1=C(C=C(C=C1)[N+](=O)[O-])C#N)[NH+](C)C

Isomeric SMILES

CC(C)C[C@H](CNC1=C(C=C(C=C1)[N+](=O)[O-])C#N)[NH+](C)C

InChI

InChI=1S/C15H22N4O2/c1-11(2)7-14(18(3)4)10-17-15-6-5-13(19(20)21)8-12(15)9-16/h5-6,8,11,14,17H,7,10H2,1-4H3/p+1/t14-/m1/s1