3-(4-decoxyphenyl)-1-[(2S)-2-methylbutoxy]-2-nitro-4-phenyl-benzene

Systemtic Name: 3-(4-decoxyphenyl)-1-[(2S)-2-methylbutoxy]-2-nitro-4-phenyl-benzene Openeye Name: 3-(4-decoxyphenyl)-1-[(2S)-2-methylbutoxy]-2-nitro-4-phenyl-benzene CAS Name: 3-(4-decoxyphenyl)-1-[(2S)-2-methylbutoxy]-2-nitro-4-phenylbenzene IUPAC Name: 3-(4-decoxyphenyl)-1-[(2S)-2-methylbutoxy]-2-nitro-4-phenylbenzene Traditional Name: 3-(4-decoxyphenyl)-1-[(2S)-2-methylbutoxy]-2-nitro-4-phenyl-benzene Formula: C33H43NO4 MolecularWeight: 517.69882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=C(C=CC(=C2[N+](=O)[O-])OCC(C)CC)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=C(C=CC(=C2[N+](=O)[O-])OC[C@@H](C)CC)C3=CC=CC=C3

InChI

InChI=1S/C33H43NO4/c1-4-6-7-8-9-10-11-15-24-37-29-20-18-28(19-21-29)32-30(27-16-13-12-14-17-27)22-23-31(33(32)34(35)36)38-25-26(3)5-2/h12-14,16-23,26H,4-11,15,24-25H2,1-3H3/t26-/m0/s1