4-[(1R)-2-azaniumyl-1-(2,3-dihydroindol-1-yl)ethyl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[(1R)-2-azaniumyl-1-(2,3-dihydroindol-1-yl)ethyl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(1R)-2-azaniumyl-1-indolin-1-yl-ethyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(1R)-2-ammonio-1-(2,3-dihydroindol-1-yl)ethyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(1R)-2-azaniumyl-1-(2,3-dihydroindol-1-yl)ethyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(1R)-2-ammonio-1-indolin-1-yl-ethyl]-2-methoxy-6-nitro-phenolate Formula: C17H19N3O4 MolecularWeight: 329.35046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])C(C[NH3+])N2CCC3=CC=CC=C32

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])[C@H](C[NH3+])N2CCC3=CC=CC=C32

InChI

InChI=1S/C17H19N3O4/c1-24-16-9-12(8-14(17(16)21)20(22)23)15(10-18)19-7-6-11-4-2-3-5-13(11)19/h2-5,8-9,15,21H,6-7,10,18H2,1H3/t15-/m0/s1