1-methoxy-4-[(2S)-1-nitrobutan-2-yl]benzene

Systemtic Name: 1-methoxy-4-[(2S)-1-nitrobutan-2-yl]benzene Openeye Name: 1-methoxy-4-[(1S)-1-(nitromethyl)propyl]benzene CAS Name: 1-methoxy-4-[(2S)-1-nitrobutan-2-yl]benzene IUPAC Name: 1-methoxy-4-[(2S)-1-nitrobutan-2-yl]benzene Traditional Name: 1-methoxy-4-[(1S)-1-(nitromethyl)propyl]benzene Formula: C11H15NO3 MolecularWeight: 209.2417

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15NO3/c1-3-9(8-12(13)14)10-4-6-11(15-2)7-5-10/h4-7,9H,3,8H2,1-2H3/t9-/m1/s1