(2S)-1-(1H-indol-3-yl)-2-(4-methyl-2-nitro-phenoxy)propan-1-one

Systemtic Name: (2S)-1-(1H-indol-3-yl)-2-(4-methyl-2-nitro-phenoxy)propan-1-one Openeye Name: (2S)-1-(1H-indol-3-yl)-2-(4-methyl-2-nitro-phenoxy)propan-1-one CAS Name: (2S)-1-(1H-indol-3-yl)-2-(4-methyl-2-nitrophenoxy)-1-propanone IUPAC Name: (2S)-1-(1H-indol-3-yl)-2-(4-methyl-2-nitrophenoxy)propan-1-one Traditional Name: (2S)-1-(1H-indol-3-yl)-2-(4-methyl-2-nitro-phenoxy)propan-1-one Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(C)C(=O)C2=CNC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)O[C@@H](C)C(=O)C2=CNC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O4/c1-11-7-8-17(16(9-11)20(22)23)24-12(2)18(21)14-10-19-15-6-4-3-5-13(14)15/h3-10,12,19H,1-2H3/t12-/m0/s1