[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]azanium

Systemtic Name: [(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]azanium Openeye Name: [(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium CAS Name: [(1S)-1-(4-methyl-3-nitrophenyl)ethyl]ammonium IUPAC Name: [(1S)-1-(4-methyl-3-nitrophenyl)ethyl]azanium Traditional Name: [(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium Formula: C9H13N2O2+ MolecularWeight: 181.21172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)[NH3+])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[C@H](C)[NH3+])[N+](=O)[O-]

InChI

InChI=1S/C9H12N2O2/c1-6-3-4-8(7(2)10)5-9(6)11(12)13/h3-5,7H,10H2,1-2H3/p+1/t7-/m0/s1