cyclopenta-1,3-diene; 2-cyclopenta-2,4-dien-1-yl-4-(2-methylpropyl)-6-pentan-3-yl-1,3,2-dioxaborinane; iron

Systemtic Name: cyclopenta-1,3-diene; 2-cyclopenta-2,4-dien-1-yl-4-(2-methylpropyl)-6-pentan-3-yl-1,3,2-dioxaborinane; iron Openeye Name: cyclopenta-1,3-diene; 2-cyclopenta-2,4-dien-1-yl-4-(1-ethylpropyl)-6-isobutyl-1,3,2-dioxaborinane; iron CAS Name: cyclopenta-1,3-diene; 2-(1-cyclopenta-2,4-dienyl)-4-(2-methylpropyl)-6-pentan-3-yl-1,3,2-dioxaborinane; iron IUPAC Name: cyclopenta-1,3-diene; 2-cyclopenta-2,4-dien-1-yl-4-(2-methylpropyl)-6-pentan-3-yl-1,3,2-dioxaborinane; iron Traditional Name: cyclopenta-1,3-diene; 2-cyclopenta-2,4-dien-1-yl-4-(1-ethylpropyl)-6-isobutyl-1,3,2-dioxaborinane; iron Formula: C22H33BFeO2-2 MolecularWeight: 396.15222

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Descriptors Computed from Structure

Canonical SMILES:

B1(OC(CC(O1)C(CC)CC)CC(C)C)[C-]2C=CC=C2.[CH-]1C=CC=C1.[Fe]

Isomeric SMILES

B1(OC(CC(O1)C(CC)CC)CC(C)C)[C-]2C=CC=C2.[CH-]1C=CC=C1.[Fe]

InChI

InChI=1S/C17H28BO2.C5H5.Fe/c1-5-14(6-2)17-12-16(11-13(3)4)19-18(20-17)15-9-7-8-10-15;1-2-4-5-3-1;/h7-10,13-14,16-17H,5-6,11-12H2,1-4H3;1-5H;/q2*-1;