[(2S)-3-(4-methoxy-2-nitro-phenoxy)-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: [(2S)-3-(4-methoxy-2-nitro-phenoxy)-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2S)-2-hydroxy-3-(4-methoxy-2-nitro-phenoxy)propyl]-methyl-ammonium CAS Name: [(2S)-2-hydroxy-3-(4-methoxy-2-nitrophenoxy)propyl]-methylammonium IUPAC Name: [(2S)-2-hydroxy-3-(4-methoxy-2-nitrophenoxy)propyl]-methylazanium Traditional Name: [(2S)-2-hydroxy-3-(4-methoxy-2-nitro-phenoxy)propyl]-methyl-ammonium Formula: C11H17N2O5+ MolecularWeight: 257.26308

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(COC1=C(C=C(C=C1)OC)[N+](=O)[O-])O

Isomeric SMILES

C[NH2+]C[C@@H](COC1=C(C=C(C=C1)OC)[N+](=O)[O-])O

InChI

InChI=1S/C11H16N2O5/c1-12-6-8(14)7-18-11-4-3-9(17-2)5-10(11)13(15)16/h3-5,8,12,14H,6-7H2,1-2H3/p+1/t8-/m0/s1