[(1S)-3-methoxy-1-(3-nitrophenyl)-3-oxidanylidene-propyl]azanium

Systemtic Name: [(1S)-3-methoxy-1-(3-nitrophenyl)-3-oxidanylidene-propyl]azanium Openeye Name: [(1S)-3-methoxy-1-(3-nitrophenyl)-3-oxo-propyl]ammonium CAS Name: [(1S)-3-methoxy-1-(3-nitrophenyl)-3-oxopropyl]ammonium IUPAC Name: [(1S)-3-methoxy-1-(3-nitrophenyl)-3-oxopropyl]azanium Traditional Name: [(1S)-3-keto-3-methoxy-1-(3-nitrophenyl)propyl]ammonium Formula: C10H13N2O4+ MolecularWeight: 225.22122

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC(=CC=C1)[N+](=O)[O-])[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C10H12N2O4/c1-16-10(13)6-9(11)7-3-2-4-8(5-7)12(14)15/h2-5,9H,6,11H2,1H3/p+1/t9-/m0/s1