benzene; 2,2,2-tris(1-methylimidazol-2-yl)ethanol

Systemtic Name: benzene; 2,2,2-tris(1-methylimidazol-2-yl)ethanol Openeye Name: benzene; 2,2,2-tris(1-methylimidazol-2-yl)ethanol CAS Name: benzene; 2,2,2-tris(1-methyl-2-imidazolyl)ethanol IUPAC Name: benzene; 2,2,2-tris(1-methylimidazol-2-yl)ethanol Traditional Name: benzene; 2,2,2-tris(1-methylimidazol-2-yl)ethanol Formula: C34H42N12O2 MolecularWeight: 650.77648

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(CO)(C2=NC=CN2C)C3=NC=CN3C.CN1C=CN=C1C(CO)(C2=NC=CN2C)C3=NC=CN3C.C1=CC=CC=C1

Isomeric SMILES

CN1C=CN=C1C(CO)(C2=NC=CN2C)C3=NC=CN3C.CN1C=CN=C1C(CO)(C2=NC=CN2C)C3=NC=CN3C.C1=CC=CC=C1

InChI

InChI=1S/2C14H18N6O.C6H6/c2*1-18-7-4-15-11(18)14(10-21,12-16-5-8-19(12)2)13-17-6-9-20(13)3;1-2-4-6-5-3-1/h2*4-9,21H,10H2,1-3H3;1-6H