methyl-[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]azanium

Systemtic Name: methyl-[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]azanium Openeye Name: [(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]-methyl-ammonium CAS Name: [(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]-methylammonium IUPAC Name: [(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]-methylazanium Traditional Name: [(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]-methyl-ammonium Formula: C9H13N2O3+ MolecularWeight: 197.21112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12N2O3/c1-10-6-9(12)7-2-4-8(5-3-7)11(13)14/h2-5,9-10,12H,6H2,1H3/p+1/t9-/m1/s1