[(2S)-1-ethoxy-3-(5-nitro-1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-ethoxy-3-(5-nitro-1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-ethoxy-1-[(5-nitro-1H-indol-3-yl)methyl]-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-ethoxy-3-(5-nitro-1H-indol-3-yl)-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-ethoxy-3-(5-nitro-1H-indol-3-yl)-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-ethoxy-2-keto-1-[(5-nitro-1H-indol-3-yl)methyl]ethyl]ammonium Formula: C13H16N3O4+ MolecularWeight: 278.28384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CNC2=C1C=C(C=C2)[N+](=O)[O-])[NH3+]

Isomeric SMILES

CCOC(=O)[C@H](CC1=CNC2=C1C=C(C=C2)[N+](=O)[O-])[NH3+]

InChI

InChI=1S/C13H15N3O4/c1-2-20-13(17)11(14)5-8-7-15-12-4-3-9(16(18)19)6-10(8)12/h3-4,6-7,11,15H,2,5,14H2,1H3/p+1/t11-/m0/s1