2-[3-(2,4-dinitrophenoxy)propyl]-4-[4-(4-hydroxyphenyl)hexan-3-yl]phenol

Systemtic Name: 2-[3-(2,4-dinitrophenoxy)propyl]-4-[4-(4-hydroxyphenyl)hexan-3-yl]phenol Openeye Name: 2-[3-(2,4-dinitrophenoxy)propyl]-4-[1-ethyl-2-(4-hydroxyphenyl)butyl]phenol CAS Name: 2-[3-(2,4-dinitrophenoxy)propyl]-4-[4-(4-hydroxyphenyl)hexan-3-yl]phenol IUPAC Name: 2-[3-(2,4-dinitrophenoxy)propyl]-4-[4-(4-hydroxyphenyl)hexan-3-yl]phenol Traditional Name: 2-[3-(2,4-dinitrophenoxy)propyl]-4-[1-ethyl-2-(4-hydroxyphenyl)butyl]phenol Formula: C27H30N2O7 MolecularWeight: 494.5363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)O)C(CC)C2=CC(=C(C=C2)O)CCCOC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC(C1=CC=C(C=C1)O)C(CC)C2=CC(=C(C=C2)O)CCCOC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C27H30N2O7/c1-3-23(18-7-11-22(30)12-8-18)24(4-2)19-9-13-26(31)20(16-19)6-5-15-36-27-14-10-21(28(32)33)17-25(27)29(34)35/h7-14,16-17,23-24,30-31H,3-6,15H2,1-2H3