1-[4-[(2S)-butan-2-yl]phenyl]-2-(2-methoxy-5-nitro-phenoxy)ethanone

Systemtic Name: 1-[4-[(2S)-butan-2-yl]phenyl]-2-(2-methoxy-5-nitro-phenoxy)ethanone Openeye Name: 2-(2-methoxy-5-nitro-phenoxy)-1-[4-[(1S)-1-methylpropyl]phenyl]ethanone CAS Name: 1-[4-[(2S)-butan-2-yl]phenyl]-2-(2-methoxy-5-nitrophenoxy)ethanone IUPAC Name: 1-[4-[(2S)-butan-2-yl]phenyl]-2-(2-methoxy-5-nitrophenoxy)ethanone Traditional Name: 2-(2-methoxy-5-nitro-phenoxy)-1-[4-[(1S)-1-methylpropyl]phenyl]ethanone Formula: C19H21NO5 MolecularWeight: 343.37374

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(=O)COC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)C(=O)COC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C19H21NO5/c1-4-13(2)14-5-7-15(8-6-14)17(21)12-25-19-11-16(20(22)23)9-10-18(19)24-3/h5-11,13H,4,12H2,1-3H3/t13-/m0/s1