2-[[(2S)-3-(1H-indol-3-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[(2S)-3-(1H-indol-3-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[[(1S)-1-(1H-indol-3-ylmethyl)-2-methoxy-2-oxo-ethyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-[[(2S)-3-(1H-indol-3-yl)-1-methoxy-1-oxopropan-2-yl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[(2S)-3-(1H-indol-3-yl)-1-methoxy-1-oxopropan-2-yl]iminomethyl]-4-nitrophenolate Traditional Name: 2-[[(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-methoxy-ethyl]iminomethyl]-4-nitro-phenolate Formula: C19H16N3O5- MolecularWeight: 366.34744

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

COC(=O)[C@H](CC1=CNC2=CC=CC=C21)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C19H17N3O5/c1-27-19(24)17(9-12-10-20-16-5-3-2-4-15(12)16)21-11-13-8-14(22(25)26)6-7-18(13)23/h2-8,10-11,17,20,23H,9H2,1H3/p-1/t17-/m0/s1