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

Systemtic Name: 2-hydroxyethyl-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]azanium Openeye Name: 2-hydroxyethyl-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium CAS Name: 2-hydroxyethyl-[(1S)-1-(4-methyl-3-nitrophenyl)ethyl]ammonium IUPAC Name: 2-hydroxyethyl-[(1S)-1-(4-methyl-3-nitrophenyl)ethyl]azanium Traditional Name: 2-hydroxyethyl-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium Formula: C11H17N2O3+ MolecularWeight: 225.26428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O3/c1-8-3-4-10(7-11(8)13(15)16)9(2)12-5-6-14/h3-4,7,9,12,14H,5-6H2,1-2H3/p+1/t9-/m0/s1