1-methoxy-4-[(1S)-2-nitro-1-[(2R,3E)-octa-3,7-dien-2-yl]oxy-ethyl]benzene

Systemtic Name: 1-methoxy-4-[(1S)-2-nitro-1-[(2R,3E)-octa-3,7-dien-2-yl]oxy-ethyl]benzene Openeye Name: 1-methoxy-4-[(1S)-1-[(1R,2E)-1-methylhepta-2,6-dienoxy]-2-nitro-ethyl]benzene CAS Name: 1-methoxy-4-[(1S)-2-nitro-1-[(2R,3E)-octa-3,7-dien-2-yl]oxyethyl]benzene IUPAC Name: 1-methoxy-4-[(1S)-2-nitro-1-[(2R,3E)-octa-3,7-dien-2-yl]oxyethyl]benzene Traditional Name: 1-methoxy-4-[(1S)-1-[(1R,2E)-1-methylhepta-2,6-dienoxy]-2-nitro-ethyl]benzene Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO4/c1-4-5-6-7-8-14(2)22-17(13-18(19)20)15-9-11-16(21-3)12-10-15/h4,7-12,14,17H,1,5-6,13H2,2-3H3/b8-7+/t14-,17-/m1/s1