[(1R)-1-(4-methyl-3-nitro-phenyl)ethyl]-propan-2-yl-azanium

Systemtic Name: [(1R)-1-(4-methyl-3-nitro-phenyl)ethyl]-propan-2-yl-azanium Openeye Name: isopropyl-[(1R)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium CAS Name: [(1R)-1-(4-methyl-3-nitrophenyl)ethyl]-propan-2-ylammonium IUPAC Name: [(1R)-1-(4-methyl-3-nitrophenyl)ethyl]-propan-2-ylazanium Traditional Name: isopropyl-[(1R)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium Formula: C12H19N2O2+ MolecularWeight: 223.29146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)[NH2+]C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[C@@H](C)[NH2+]C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H18N2O2/c1-8(2)13-10(4)11-6-5-9(3)12(7-11)14(15)16/h5-8,10,13H,1-4H3/p+1/t10-/m1/s1