1,4-dibutyl-5,6,7,8-tetraethyl-2,3-bis(hept-2-ynyl)anthracene

Systemtic Name: 1,4-dibutyl-5,6,7,8-tetraethyl-2,3-bis(hept-2-ynyl)anthracene Openeye Name: 1,4-dibutyl-5,6,7,8-tetraethyl-2,3-bis(hept-2-ynyl)anthracene CAS Name: 1,4-dibutyl-5,6,7,8-tetraethyl-2,3-bis(hept-2-ynyl)anthracene IUPAC Name: 1,4-dibutyl-5,6,7,8-tetraethyl-2,3-bis(hept-2-ynyl)anthracene Traditional Name: 1,4-dibutyl-5,6,7,8-tetraethyl-2,3-bis(hept-2-ynyl)anthracene Formula: C44H62 MolecularWeight: 590.96308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CCC1=C(C2=CC3=C(C=C2C(=C1CC#CCCCC)CCCC)C(=C(C(=C3CC)CC)CC)CC)CCCC

Isomeric SMILES

CCCCC#CCC1=C(C2=CC3=C(C=C2C(=C1CC#CCCCC)CCCC)C(=C(C(=C3CC)CC)CC)CC)CCCC

InChI

InChI=1S/C44H62/c1-9-17-21-23-25-29-37-38(30-26-24-22-18-10-2)40(28-20-12-4)44-32-42-36(16-8)34(14-6)33(13-5)35(15-7)41(42)31-43(44)39(37)27-19-11-3/h31-32H,9-22,27-30H2,1-8H3