9-[3-[2-[3-(2,4-dinitrophenoxy)prop-1-ynyl]phenyl]prop-2-ynoxymethyl]anthracene

Systemtic Name: 9-[3-[2-[3-(2,4-dinitrophenoxy)prop-1-ynyl]phenyl]prop-2-ynoxymethyl]anthracene Openeye Name: 9-[3-[2-[3-(2,4-dinitrophenoxy)prop-1-ynyl]phenyl]prop-2-ynoxymethyl]anthracene CAS Name: 9-[3-[2-[3-(2,4-dinitrophenoxy)prop-1-ynyl]phenyl]prop-2-ynoxymethyl]anthracene IUPAC Name: 9-[3-[2-[3-(2,4-dinitrophenoxy)prop-1-ynyl]phenyl]prop-2-ynoxymethyl]anthracene Traditional Name: 9-[3-[2-[3-(2,4-dinitrophenoxy)prop-1-ynyl]phenyl]prop-2-ynoxymethyl]anthracene Formula: C33H22N2O6 MolecularWeight: 542.53758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2COCC#CC4=CC=CC=C4C#CCOC5=C(C=C(C=C5)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2COCC#CC4=CC=CC=C4C#CCOC5=C(C=C(C=C5)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C33H22N2O6/c36-34(37)28-17-18-33(32(22-28)35(38)39)41-20-8-14-25-10-2-1-9-24(25)13-7-19-40-23-31-29-15-5-3-11-26(29)21-27-12-4-6-16-30(27)31/h1-6,9-12,15-18,21-22H,19-20,23H2